1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]isonipecotamide Formula: C24H35N5O4S MolecularWeight: 489.6308

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C)N(C)C

InChI

InChI=1S/C24H35N5O4S/c1-5-17-6-8-18(9-7-17)22(27(2)3)15-26-24(31)19-10-12-29(13-11-19)34(32,33)20-14-21(23(25)30)28(4)16-20/h6-9,14,16,19,22H,5,10-13,15H2,1-4H3,(H2,25,30)(H,26,31)