3-(2-METHYL-1,3-DITHIOLAN-2-YL)-1H-INDOLE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H13NS2
Molecular Weight	235.368
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(2-METHYL-1,3-DITHIOLAN-2-YL)-1H-INDOLE

Structure Search

SMILES

CC1(SCCS1)C2=CNC3=C2C=CC=C3

InChI

InChIKey=TVPVFCFPZXJBGP-UHFFFAOYSA-N

InChI=1S/C12H13NS2/c1-12(14-6-7-15-12)10-8-13-11-5-3-2-4-9(10)11/h2-5,8,13H,6-7H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H13NS2
Molecular Weight	235.368
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 19:39:52 GMT 2025` Edited by `admin` on `Mon Mar 31 19:39:52 GMT 2025`
Record UNII	50SBH18JO5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-INDOLE, 3-(2-METHYL-1,3-DITHIOLAN-2-YL)-

Preferred Name

English

3-(2-METHYL-1,3-DITHIOLAN-2-YL)-1H-INDOLE

Systematic Name

English

2-(3-INDOLYL)-2-METHYL-1,3-DITHIOLANE

Systematic Name

English

3-(2-METHYL-1,3-DITHIOLAN-2-YL)INDOLE

Systematic Name

English

INDOLE, 3-(2-METHYL-1,3-DITHIOLAN-2-YL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60203434

Created by admin on Mon Mar 31 19:39:52 GMT 2025 , Edited by admin on Mon Mar 31 19:39:52 GMT 2025

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CAS

54921-44-7

Created by admin on Mon Mar 31 19:39:52 GMT 2025 , Edited by admin on Mon Mar 31 19:39:52 GMT 2025

PRIMARY

PUBCHEM

41233

Created by admin on Mon Mar 31 19:39:52 GMT 2025 , Edited by admin on Mon Mar 31 19:39:52 GMT 2025

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FDA UNII

50SBH18JO5

Created by admin on Mon Mar 31 19:39:52 GMT 2025 , Edited by admin on Mon Mar 31 19:39:52 GMT 2025

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