1-ethanoyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydroindole-5-sulfonamide

Systemtic Name: 1-ethanoyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydroindole-5-sulfonamide Openeye Name: 1-acetyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]indoline-5-sulfonamide CAS Name: 1-acetyl-N-[4-(3-pyridinylmethylthio)phenyl]-2,3-dihydroindole-5-sulfonamide IUPAC Name: 1-acetyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydroindole-5-sulfonamide Traditional Name: 1-acetyl-N-[4-(3-pyridylmethylthio)phenyl]indoline-5-sulfonamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C22H21N3O3S2/c1-16(26)25-12-10-18-13-21(8-9-22(18)25)30(27,28)24-19-4-6-20(7-5-19)29-15-17-3-2-11-23-14-17/h2-9,11,13-14,24H,10,12,15H2,1H3