[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-isopropyl-4-quinolyl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-propan-2-yl-4-quinolinyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(2-isopropyl-4-quinolyl)methanone Formula: C25H29N3O3S MolecularWeight: 451.58106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O3S/c1-17(2)24-16-22(21-7-5-6-8-23(21)26-24)25(29)27-11-13-28(14-12-27)32(30,31)20-10-9-18(3)19(4)15-20/h5-10,15-17H,11-14H2,1-4H3