(3S)-1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-(1-methylsulfonylindoline-5-carbonyl)-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)-oxomethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-(1-mesylindoline-5-carbonyl)-N-phenyl-nipecotamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCCC(C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCC[C@@H](C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4S/c1-30(28,29)25-13-11-16-14-17(9-10-20(16)25)22(27)24-12-5-6-18(15-24)21(26)23-19-7-3-2-4-8-19/h2-4,7-10,14,18H,5-6,11-13,15H2,1H3,(H,23,26)/t18-/m0/s1