1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(2-methyl-2-piperidin-1-yl-propyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(2-methyl-2-piperidin-1-yl-propyl)piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[2-methyl-2-(1-piperidyl)propyl]piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-[2-methyl-2-(1-piperidinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-(2-methyl-2-piperidin-1-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(2-methyl-2-piperidino-propyl)isonipecotamide Formula: C21H35N5O4S MolecularWeight: 453.5987

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)N3CCCCC3

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)N3CCCCC3

InChI

InChI=1S/C21H35N5O4S/c1-21(2,25-9-5-4-6-10-25)15-23-20(28)16-7-11-26(12-8-16)31(29,30)17-13-18(19(22)27)24(3)14-17/h13-14,16H,4-12,15H2,1-3H3,(H2,22,27)(H,23,28)