N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]-2-methyl-propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]-2-methyl-propyl]-1-tosyl-isonipecotamide Formula: C28H36N4O4S MolecularWeight: 524.67484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C(C)C)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N[C@@H](C(C)C)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C28H36N4O4S/c1-19(2)26(28(34)29-15-12-22-18-30-25-7-5-4-6-24(22)25)31-27(33)21-13-16-32(17-14-21)37(35,36)23-10-8-20(3)9-11-23/h4-11,18-19,21,26,30H,12-17H2,1-3H3,(H,29,34)(H,31,33)/t26-/m0/s1