BUTOCONAZOLE NITRATE, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H17Cl3N2S.HNO3
Molecular Weight	474.789
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[N+]([O-])=O.ClC1=CC=C(CC[C@@H](CN2C=CN=C2)SC3=C(Cl)C=CC=C3Cl)C=C1

InChI

InChIKey=ZHPWRQIPPNZNML-NTISSMGPSA-N

InChI=1S/C19H17Cl3N2S.HNO3/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22;2-1(3)4/h1-5,7-8,10-11,13,16H,6,9,12H2;(H,2,3,4)/t16-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	HNO3
Molecular Weight	63.0128
Charge	0
Count

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

Molecular Formula	C19H17Cl3N2S
Molecular Weight	411.776
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:27:34 UTC 2023` Edited by `admin` on `Sat Dec 16 11:27:34 UTC 2023`
Record UNII	1HVW063ZS9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUTOCONAZOLE NITRATE, (S)-

Common Name

English

(+)-BUTOCONAZOLE NITRATE

Common Name

English

1H-IMIDAZOLE, 1-(4-(4-CHLOROPHENYL)-2-((2,6-DICHLOROPHENYL)THIO)BUTYL)-, (S)-, MONONITRATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

45266833

Created by admin on Sat Dec 16 11:27:34 UTC 2023 , Edited by admin on Sat Dec 16 11:27:34 UTC 2023

PRIMARY

CAS

151909-75-0

Created by admin on Sat Dec 16 11:27:34 UTC 2023 , Edited by admin on Sat Dec 16 11:27:34 UTC 2023

PRIMARY

FDA UNII

1HVW063ZS9

Created by admin on Sat Dec 16 11:27:34 UTC 2023 , Edited by admin on Sat Dec 16 11:27:34 UTC 2023

PRIMARY

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