Basic information
- Standard SMILES
CN(c1cccc2cc(C(N)=S)[nH]c12)S(=O)(=O)c1cccs1- InChIKey
AGFWMKUEJKDKIZ-UHFFFAOYSA-N- Molecular formula
- C14H13N3O2S3
- Average molar mass
- 351.5 g/mol
- Monoisotopic mass
- 351.01699019
Names & identifiers
- Preferred name
- 7-[methyl(2-thienylsulfonyl)amino]-1H-indole-2-carbothioamide
- IUPAC
- 7-[methyl(thiophen-2-ylsulfonyl)amino]-1H-indole-2-carbothioamide
Names & synonyms
SCHEMBL1653817AGFWMKUEJKDKIZ-UHFFFAOYSA-N7-[methyl(2-thienylsulfonyl)amino]-1H-indole-2-carbothioamide
Database identifiers
- PubChem CID
- 57475960
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 148 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 534
Related reactions
19 records
Compound notes
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