5-(azepan-1-ylsulfonyl)-1-ethanoyl-N-(thiophen-2-ylmethyl)-2,3-dihydroindole-2-carboxamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-1-ethanoyl-N-(thiophen-2-ylmethyl)-2,3-dihydroindole-2-carboxamide Openeye Name: 1-acetyl-5-(azepan-1-ylsulfonyl)-N-(2-thienylmethyl)indoline-2-carboxamide CAS Name: 1-acetyl-5-(1-azepanylsulfonyl)-N-(thiophen-2-ylmethyl)-2,3-dihydroindole-2-carboxamide IUPAC Name: 1-acetyl-5-(azepan-1-ylsulfonyl)-N-(thiophen-2-ylmethyl)-2,3-dihydroindole-2-carboxamide Traditional Name: 1-acetyl-5-(azepan-1-ylsulfonyl)-N-(2-thenyl)indoline-2-carboxamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4=CC=CS4

Isomeric SMILES

CC(=O)N1C(CC2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H27N3O4S2/c1-16(26)25-20-9-8-19(31(28,29)24-10-4-2-3-5-11-24)13-17(20)14-21(25)22(27)23-15-18-7-6-12-30-18/h6-9,12-13,21H,2-5,10-11,14-15H2,1H3,(H,23,27)