3-butyl-4-(3-chlorophenyl)sulfonyl-N2-methyl-N2-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide

Systemtic Name: 3-butyl-4-(3-chlorophenyl)sulfonyl-N2-methyl-N2-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide Openeye Name: 3-butyl-4-(3-chlorophenyl)sulfonyl-N2-methyl-N2-(6-quinolylmethyl)-1H-pyrrole-2,5-dicarboxamide CAS Name: 3-butyl-4-(3-chlorophenyl)sulfonyl-N2-methyl-N2-(6-quinolinylmethyl)-1H-pyrrole-2,5-dicarboxamide IUPAC Name: 3-butyl-4-(3-chlorophenyl)sulfonyl-2-N-methyl-2-N-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide Traditional Name: 3-butyl-4-(3-chlorophenyl)sulfonyl-N-methyl-N-(6-quinolylmethyl)-1H-pyrrole-2,5-dicarboxamide Formula: C27H27ClN4O4S MolecularWeight: 539.04568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=C1S(=O)(=O)C2=CC(=CC=C2)Cl)C(=O)N)C(=O)N(C)CC3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

CCCCC1=C(NC(=C1S(=O)(=O)C2=CC(=CC=C2)Cl)C(=O)N)C(=O)N(C)CC3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C27H27ClN4O4S/c1-3-4-10-21-23(27(34)32(2)16-17-11-12-22-18(14-17)7-6-13-30-22)31-24(26(29)33)25(21)37(35,36)20-9-5-8-19(28)15-20/h5-9,11-15,31H,3-4,10,16H2,1-2H3,(H2,29,33)