3-(p-Methoxyphenyl)-5-nitro-2-phenylbenzo(b)thiophene

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H15NO3S
Molecular Weight	361.414
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(p-Methoxyphenyl)-5-nitro-2-phenylbenzo(b)thiophene

Structure Search

SMILES

COC1=CC=C(C=C1)C2=C(SC3=C2C=C(C=C3)[N+]([O-])=O)C4=CC=CC=C4

InChI

InChIKey=VKUYFWWGGQCZBO-UHFFFAOYSA-N

InChI=1S/C21H15NO3S/c1-25-17-10-7-14(8-11-17)20-18-13-16(22(23)24)9-12-19(18)26-21(20)15-5-3-2-4-6-15/h2-13H,1H3

HIDE SMILES / InChI

Molecular Formula	C21H15NO3S
Molecular Weight	361.414
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:24:03 GMT 2025` Edited by `admin` on `Mon Mar 31 22:24:03 GMT 2025`
Record UNII	XR2ZX8GHG7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(4-Methoxyphenyl)-5-nitro-2-phenylbenzo[b]thiophene

Preferred Name

English

3-(p-Methoxyphenyl)-5-nitro-2-phenylbenzo(b)thiophene

Systematic Name

English

3-(4-methoxyphenyl)-5-nitro-2-phenyl-1-benzothiophene

Systematic Name

English

Benzo(b)thiophene, 3-(p-methoxyphenyl)-5-nitro-2-phenyl-

Systematic Name

English

Benzo[b]thiophene, 3-(4-methoxyphenyl)-5-nitro-2-phenyl-

Systematic Name

English

Code System Code Type Description

PUBCHEM

37409

Created by admin on Mon Mar 31 22:24:03 GMT 2025 , Edited by admin on Mon Mar 31 22:24:03 GMT 2025

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EPA CompTox

DTXSID20189806

Created by admin on Mon Mar 31 22:24:03 GMT 2025 , Edited by admin on Mon Mar 31 22:24:03 GMT 2025

PRIMARY

CAS

36266-70-3

Created by admin on Mon Mar 31 22:24:03 GMT 2025 , Edited by admin on Mon Mar 31 22:24:03 GMT 2025

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FDA UNII

XR2ZX8GHG7

Created by admin on Mon Mar 31 22:24:03 GMT 2025 , Edited by admin on Mon Mar 31 22:24:03 GMT 2025

PRIMARY