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

Systemtic Name: 3-butyl-4-(3,5-dimethylphenyl)sulfonyl-N2-methyl-N2-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide Openeye Name: 3-butyl-4-(3,5-dimethylphenyl)sulfonyl-N2-methyl-N2-(6-quinolylmethyl)-1H-pyrrole-2,5-dicarboxamide CAS Name: 3-butyl-4-(3,5-dimethylphenyl)sulfonyl-N2-methyl-N2-(6-quinolinylmethyl)-1H-pyrrole-2,5-dicarboxamide IUPAC Name: 3-butyl-4-(3,5-dimethylphenyl)sulfonyl-2-N-methyl-2-N-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide Traditional Name: 3-butyl-4-(3,5-dimethylphenyl)sulfonyl-N-methyl-N-(6-quinolylmethyl)-1H-pyrrole-2,5-dicarboxamide Formula: C29H32N4O4S MolecularWeight: 532.65378

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H32N4O4S/c1-5-6-9-23-25(29(35)33(4)17-20-10-11-24-21(16-20)8-7-12-31-24)32-26(28(30)34)27(23)38(36,37)22-14-18(2)13-19(3)15-22/h7-8,10-16,32H,5-6,9,17H2,1-4H3,(H2,30,34)