N5-methyl-3-(phenylsulfonyl)-4-propyl-N5-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide

Systemtic Name: N5-methyl-3-(phenylsulfonyl)-4-propyl-N5-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide Openeye Name: 3-(benzenesulfonyl)-N5-methyl-4-propyl-N5-(6-quinolylmethyl)-1H-pyrrole-2,5-dicarboxamide CAS Name: 3-(benzenesulfonyl)-N5-methyl-4-propyl-N5-(6-quinolinylmethyl)-1H-pyrrole-2,5-dicarboxamide IUPAC Name: 3-(benzenesulfonyl)-5-N-methyl-4-propyl-5-N-(quinolin-6-ylmethyl)-1H-pyrrole-2,5-dicarboxamide Traditional Name: 3-besyl-N'-methyl-4-propyl-N'-(6-quinolylmethyl)-1H-pyrrole-2,5-dicarboxamide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1S(=O)(=O)C2=CC=CC=C2)C(=O)N)C(=O)N(C)CC3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

CCCC1=C(NC(=C1S(=O)(=O)C2=CC=CC=C2)C(=O)N)C(=O)N(C)CC3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C26H26N4O4S/c1-3-8-20-22(26(32)30(2)16-17-12-13-21-18(15-17)9-7-14-28-21)29-23(25(27)31)24(20)35(33,34)19-10-5-4-6-11-19/h4-7,9-15,29H,3,8,16H2,1-2H3,(H2,27,31)