4-[4-(3-bromophenyl)carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-(3-bromophenyl)carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-(3-bromobenzoyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[(3-bromophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-(3-bromobenzoyl)piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-(3-bromobenzoyl)piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C17H19BrN4O4S MolecularWeight: 455.32616

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H19BrN4O4S/c1-20-11-14(10-15(20)16(19)23)27(25,26)22-7-5-21(6-8-22)17(24)12-3-2-4-13(18)9-12/h2-4,9-11H,5-8H2,1H3,(H2,19,23)