1-[2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[3-(o-tolylmethylsulfonyl)indol-1-yl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[3-[(2-methylphenyl)methylsulfonyl]-1-indolyl]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[3-(2-methylbenzyl)sulfonylindol-1-yl]acetyl]isonipecotamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C24H27N3O4S/c1-17-6-2-3-7-19(17)16-32(30,31)22-14-27(21-9-5-4-8-20(21)22)15-23(28)26-12-10-18(11-13-26)24(25)29/h2-9,14,18H,10-13,15-16H2,1H3,(H2,25,29)