INO-3178

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H19NOS
Molecular Weight	285.404
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of INO-3178

Structure Search

SMILES

C=CCN(CCC(=O)C1=CC2=CC=CC=C2S1)CC=C

InChI

InChIKey=AITPVIQGEYMBPC-UHFFFAOYSA-N

InChI=1S/C17H19NOS/c1-3-10-18(11-4-2)12-9-15(19)17-13-14-7-5-6-8-16(14)20-17/h3-8,13H,1-2,9-12H2

HIDE SMILES / InChI

Molecular Formula	C17H19NOS
Molecular Weight	285.404
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 `Fri Dec 15 17:18:11 GMT 2023` Edited by `admin` on `Fri Dec 15 17:18:11 GMT 2023`
Record UNII	5Y0Q1D3T8B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

INO-3178

Common Name

English

3178 AQ

Common Name

English

1-PROPANONE, 1-BENZO(B)THIEN-2-YL-3-(DI-2-PROPENYLAMINO)-

Systematic Name

English

1-PROPANONE, 1-BENZO(B)THIEN-2-YL-3-(DI-2-PROPEN-1-YLAMINO)-

Systematic Name

English

AQ 3178

Code

English

AQ-3178

Code

English

Code System Code Type Description

CAS

61508-29-0

Created by admin on Fri Dec 15 17:18:11 GMT 2023 , Edited by admin on Fri Dec 15 17:18:11 GMT 2023

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PUBCHEM

124882

Created by admin on Fri Dec 15 17:18:11 GMT 2023 , Edited by admin on Fri Dec 15 17:18:11 GMT 2023

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FDA UNII

5Y0Q1D3T8B

Created by admin on Fri Dec 15 17:18:11 GMT 2023 , Edited by admin on Fri Dec 15 17:18:11 GMT 2023

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EPA CompTox

DTXSID20210503

Created by admin on Fri Dec 15 17:18:11 GMT 2023 , Edited by admin on Fri Dec 15 17:18:11 GMT 2023

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MESH

C051179

Created by admin on Fri Dec 15 17:18:11 GMT 2023 , Edited by admin on Fri Dec 15 17:18:11 GMT 2023

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