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

Systemtic Name: (2-cyclopropylquinolin-4-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-cyclopropyl-4-quinolyl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-cyclopropyl-4-quinolinyl)-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-cyclopropylquinolin-4-yl)-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-cyclopropyl-4-quinolyl)-[4-(3,4-dimethylphenyl)sulfonylpiperazino]methanone Formula: C25H27N3O3S MolecularWeight: 449.56518

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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)C5CC5)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5)C

InChI

InChI=1S/C25H27N3O3S/c1-17-7-10-20(15-18(17)2)32(30,31)28-13-11-27(12-14-28)25(29)22-16-24(19-8-9-19)26-23-6-4-3-5-21(22)23/h3-7,10,15-16,19H,8-9,11-14H2,1-2H3