[8-chloranyl-2-(4-ethylphenyl)quinolin-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [8-chloranyl-2-(4-ethylphenyl)quinolin-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [8-chloro-2-(4-ethylphenyl)-4-quinolyl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: [8-chloro-2-(4-ethylphenyl)-4-quinolinyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [8-chloro-2-(4-ethylphenyl)quinolin-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: [8-chloro-2-(4-ethylphenyl)-4-quinolyl]-(4-mesylpiperazino)methanone Formula: C23H24ClN3O3S MolecularWeight: 457.97296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C23H24ClN3O3S/c1-3-16-7-9-17(10-8-16)21-15-19(18-5-4-6-20(24)22(18)25-21)23(28)26-11-13-27(14-12-26)31(2,29)30/h4-10,15H,3,11-14H2,1-2H3