(4-methylsulfonylpiperazin-1-yl)-[2-(4-propan-2-ylphenyl)quinolin-4-yl]methanone

Systemtic Name: (4-methylsulfonylpiperazin-1-yl)-[2-(4-propan-2-ylphenyl)quinolin-4-yl]methanone Openeye Name: [2-(4-isopropylphenyl)-4-quinolyl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: (4-methylsulfonyl-1-piperazinyl)-[2-(4-propan-2-ylphenyl)-4-quinolinyl]methanone IUPAC Name: (4-methylsulfonylpiperazin-1-yl)-[2-(4-propan-2-ylphenyl)quinolin-4-yl]methanone Traditional Name: (4-mesylpiperazino)-(2-p-cumenyl-4-quinolyl)methanone Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C24H27N3O3S/c1-17(2)18-8-10-19(11-9-18)23-16-21(20-6-4-5-7-22(20)25-23)24(28)26-12-14-27(15-13-26)31(3,29)30/h4-11,16-17H,12-15H2,1-3H3