1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(3-bromophenyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(3-bromophenyl)piperidine-4-carboxamide Openeye Name: N-(3-bromophenyl)-1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-bromophenyl)-1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-bromophenyl)-1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-isonipecotamide Formula: C18H21BrN4O4S MolecularWeight: 469.35274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN4O4S/c1-22-11-15(10-16(22)17(20)24)28(26,27)23-7-5-12(6-8-23)18(25)21-14-4-2-3-13(19)9-14/h2-4,9-12H,5-8H2,1H3,(H2,20,24)(H,21,25)