(3S)-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-1-(2-methylpropanoyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Openeye Name: (3S)-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide CAS Name: (3S)-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-1-(2-methyl-1-oxopropyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Traditional Name: (3S)-N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-1-isobutyryl-nipecotamide Formula: C23H34N4O5S MolecularWeight: 478.60486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C)C(=O)N1CCC[C@@H](C1)C(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C23H34N4O5S/c1-16(2)23(30)26-12-4-5-18(15-26)22(29)25-20-10-13-27(14-11-20)33(31,32)21-8-6-19(7-9-21)24-17(3)28/h6-9,16,18,20H,4-5,10-15H2,1-3H3,(H,24,28)(H,25,29)/t18-/m0/s1