(2-cyclopropylquinolin-4-yl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-cyclopropylquinolin-4-yl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-cyclopropyl-4-quinolyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-cyclopropyl-4-quinolinyl)-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-cyclopropylquinolin-4-yl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-cyclopropyl-4-quinolyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazino]methanone Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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