[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinolin-8-yl-methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinolin-8-yl-methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(8-quinolyl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(8-quinolinyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinolin-8-ylmethanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(8-quinolyl)methanone Formula: C22H23N3O3S MolecularWeight: 409.50132

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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=CC4=C3N=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C22H23N3O3S/c1-16-8-9-19(15-17(16)2)29(27,28)25-13-11-24(12-14-25)22(26)20-7-3-5-18-6-4-10-23-21(18)20/h3-10,15H,11-14H2,1-2H3