N5-[(7-chloranylquinolin-6-yl)methyl]-3-(3,5-dimethylphenyl)sulfonyl-N5,4-dimethyl-1H-pyrrole-2,5-dicarboxamide

Systemtic Name: N5-[(7-chloranylquinolin-6-yl)methyl]-3-(3,5-dimethylphenyl)sulfonyl-N5,4-dimethyl-1H-pyrrole-2,5-dicarboxamide Openeye Name: N5-[(7-chloro-6-quinolyl)methyl]-3-(3,5-dimethylphenyl)sulfonyl-N5,4-dimethyl-1H-pyrrole-2,5-dicarboxamide CAS Name: N5-[(7-chloro-6-quinolinyl)methyl]-3-(3,5-dimethylphenyl)sulfonyl-N5,4-dimethyl-1H-pyrrole-2,5-dicarboxamide IUPAC Name: 5-N-[(7-chloroquinolin-6-yl)methyl]-3-(3,5-dimethylphenyl)sulfonyl-5-N,4-dimethyl-1H-pyrrole-2,5-dicarboxamide Traditional Name: N'-[(7-chloro-6-quinolyl)methyl]-3-(3,5-dimethylphenyl)sulfonyl-N',4-dimethyl-1H-pyrrole-2,5-dicarboxamide Formula: C26H25ClN4O4S MolecularWeight: 525.0191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC(=C2C)C(=O)N(C)CC3=C(C=C4C(=C3)C=CC=N4)Cl)C(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)C2=C(NC(=C2C)C(=O)N(C)CC3=C(C=C4C(=C3)C=CC=N4)Cl)C(=O)N)C

InChI

InChI=1S/C26H25ClN4O4S/c1-14-8-15(2)10-19(9-14)36(34,35)24-16(3)22(30-23(24)25(28)32)26(33)31(4)13-18-11-17-6-5-7-29-21(17)12-20(18)27/h5-12,30H,13H2,1-4H3,(H2,28,32)