N-[2-[(5-Bromo-7-nitro-1,2-benzisothiazol-4-yl)azo]-5-(diethylamino)phenyl]-2-phenoxyacetamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H23BrN6O4S
Molecular Weight	583.457
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of N-[2-[(5-Bromo-7-nitro-1,2-benzisothiazol-4-yl)azo]-5-(diethylamino)phenyl]-2-phenoxyacetamide

Structure Search

SMILES

CCN(CC)C1=CC(NC(=O)COC2=CC=CC=C2)=C(C=C1)\N=N\C3=C(Br)C=C(C4=C3C=NS4)[N+]([O-])=O

InChI

InChIKey=CDYOIEJXFJYWAF-QVIHXGFCSA-N

InChI=1S/C25H23BrN6O4S/c1-3-31(4-2)16-10-11-20(21(12-16)28-23(33)15-36-17-8-6-5-7-9-17)29-30-24-18-14-27-37-25(18)22(32(34)35)13-19(24)26/h5-14H,3-4,15H2,1-2H3,(H,28,33)/b30-29+

HIDE SMILES / InChI

Molecular Formula	C25H23BrN6O4S
Molecular Weight	583.457
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 `Tue Apr 01 20:25:06 GMT 2025` Edited by `admin` on `Tue Apr 01 20:25:06 GMT 2025`
Record UNII	MD98N84F3X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-[2-[(5-Bromo-7-nitro-1,2-benzisothiazol-4-yl)azo]-5-(diethylamino)phenyl]-2-phenoxyacetamide

Systematic Name

English

Acetamide, N-[2-[(5-bromo-7-nitro-1,2-benzisothiazol-4-yl)azo]-5-(diethylamino)phenyl]-2-phenoxy-

Preferred Name

English

Acetamide, N-[2-[2-(5-bromo-7-nitro-1,2-benzisothiazol-4-yl)diazenyl]-5-(diethylamino)phenyl]-2-phenoxy-

Systematic Name

English

N-[2-[2-(5-Bromo-7-nitro-1,2-benzisothiazol-4-yl)diazenyl]-5-(diethylamino)phenyl]-2-phenoxyacetamide

Systematic Name

English

Code System Code Type Description

FDA UNII

MD98N84F3X