1-(1-methylpyrrol-3-yl)sulfonyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-4-carboxamide

Systemtic Name: 1-(1-methylpyrrol-3-yl)sulfonyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-1-(1-methylpyrrol-3-yl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-[(1-methyl-3-pyrrolyl)sulfonyl]-N-[1-(phenylmethyl)-3-pyrrolidinyl]-4-piperidinecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-1-(1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-1-(1-methylpyrrol-3-yl)sulfonyl-isonipecotamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H30N4O3S/c1-24-11-10-21(17-24)30(28,29)26-13-7-19(8-14-26)22(27)23-20-9-12-25(16-20)15-18-5-3-2-4-6-18/h2-6,10-11,17,19-20H,7-9,12-16H2,1H3,(H,23,27)