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

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-[(2-bromophenyl)methyl]-N-methyl-piperidine-4-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: N-(2-bromobenzyl)-1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-methyl-isonipecotamide Formula: C20H25BrN4O4S MolecularWeight: 497.4059

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=CC=C3Br

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=CC=C3Br

InChI

InChI=1S/C20H25BrN4O4S/c1-23-13-16(11-18(23)19(22)26)30(28,29)25-9-7-14(8-10-25)20(27)24(2)12-15-5-3-4-6-17(15)21/h3-6,11,13-14H,7-10,12H2,1-2H3,(H2,22,26)