[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone Openeye Name: [4-(p-tolylsulfonyl)piperazin-1-yl]-(2-quinolyl)methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-(2-quinolinyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-quinolin-2-ylmethanone Traditional Name: 2-quinolyl-(4-tosylpiperazino)methanone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21N3O3S/c1-16-6-9-18(10-7-16)28(26,27)24-14-12-23(13-15-24)21(25)20-11-8-17-4-2-3-5-19(17)22-20/h2-11H,12-15H2,1H3