1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(dimethylcarbamoyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(dimethylcarbamoyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(dimethylcarbamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-[4-[dimethylamino(oxo)methyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-[4-(dimethylcarbamoyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[4-(dimethylcarbamoyl)phenyl]isonipecotamide Formula: C21H27N5O5S MolecularWeight: 461.53458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C(=O)N(C)C

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)C(=O)N(C)C

InChI

InChI=1S/C21H27N5O5S/c1-24(2)21(29)15-4-6-16(7-5-15)23-20(28)14-8-10-26(11-9-14)32(30,31)17-12-18(19(22)27)25(3)13-17/h4-7,12-14H,8-11H2,1-3H3,(H2,22,27)(H,23,28)