C.I. Pigment Red 185 (C.I. 12516)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H24N6O6S
Molecular Weight	560.581
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of C.I. Pigment Red 185 (C.I. 12516)

Structure Search

SMILES

CNS(=O)(=O)C1=C(OC)C=C(\N=N\C2=C(O)C(=CC3=CC=CC=C23)C(=O)NC4=CC5=C(NC(=O)N5)C=C4)C(C)=C1

InChI

InChIKey=FQVVGIYUIPHSRR-ULIFNZDWSA-N

InChI=1S/C27H24N6O6S/c1-14-10-23(40(37,38)28-2)22(39-3)13-20(14)32-33-24-17-7-5-4-6-15(17)11-18(25(24)34)26(35)29-16-8-9-19-21(12-16)31-27(36)30-19/h4-13,28,34H,1-3H3,(H,29,35)(H2,30,31,36)/b33-32+

HIDE SMILES / InChI

Molecular Formula	C27H24N6O6S
Molecular Weight	560.581
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:29:29 GMT 2023` Edited by `admin` on `Sat Dec 16 08:29:29 GMT 2023`
Record UNII	8QD9FS37UV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

C.I. Pigment Red 185 (C.I. 12516)

Common Name

English

2-Naphthalenecarboxamide, N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-4-[[5-methoxy-2-methyl-4-[(methylamino)sulfonyl]phenyl]azo]-

Systematic Name

English

2-Naphthalenecarboxamide, N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-4-[2-[5-methoxy-2-methyl-4-[(methylamino)sulfonyl]phenyl]diazenyl]-

Systematic Name

English

Pigment Red 185

Common Name

English

N-(2,3-Dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-4-[2-[5-methoxy-2-methyl-4-[(methylamino)sulfonyl]phenyl]diazenyl]-2-naphthalenecarboxamide

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

263-353-1

Created by admin on Sat Dec 16 08:29:30 GMT 2023 , Edited by admin on Sat Dec 16 08:29:30 GMT 2023

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EPA CompTox

DTXSID701100733

Created by admin on Sat Dec 16 08:29:30 GMT 2023 , Edited by admin on Sat Dec 16 08:29:30 GMT 2023

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CAS

61951-98-2

Created by admin on Sat Dec 16 08:29:30 GMT 2023 , Edited by admin on Sat Dec 16 08:29:30 GMT 2023

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FDA UNII

8QD9FS37UV

Created by admin on Sat Dec 16 08:29:30 GMT 2023 , Edited by admin on Sat Dec 16 08:29:30 GMT 2023

PRIMARY