[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone

Systemtic Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone Openeye Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-[2-(4-pyridyl)-4-quinolyl]methanone CAS Name: [4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-pyridin-4-yl-4-quinolinyl)methanone IUPAC Name: [4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone Traditional Name: [4-(2,4-dimethylphenyl)sulfonylpiperazino]-[2-(4-pyridyl)-4-quinolyl]methanone Formula: C27H26N4O3S MolecularWeight: 486.58534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5)C

InChI

InChI=1S/C27H26N4O3S/c1-19-7-8-26(20(2)17-19)35(33,34)31-15-13-30(14-16-31)27(32)23-18-25(21-9-11-28-12-10-21)29-24-6-4-3-5-22(23)24/h3-12,17-18H,13-16H2,1-2H3