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

Systemtic Name: 2-methyl-1-methylsulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydroindole-5-carboxamide Openeye Name: 2-methyl-1-methylsulfonyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]indoline-5-carboxamide CAS Name: 2-methyl-1-methylsulfonyl-N-[4-(3-pyridinylmethylthio)phenyl]-2,3-dihydroindole-5-carboxamide IUPAC Name: 2-methyl-1-methylsulfonyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydroindole-5-carboxamide Traditional Name: 1-mesyl-2-methyl-N-[4-(3-pyridylmethylthio)phenyl]indoline-5-carboxamide Formula: C23H23N3O3S2 MolecularWeight: 453.57702

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C23H23N3O3S2/c1-16-12-19-13-18(5-10-22(19)26(16)31(2,28)29)23(27)25-20-6-8-21(9-7-20)30-15-17-4-3-11-24-14-17/h3-11,13-14,16H,12,15H2,1-2H3,(H,25,27)