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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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