[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-quinolyl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-quinolinyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-quinolin-2-ylmethanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(2-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=NC4=CC=CC=C4C=C3)C

Isomeric SMILES

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

InChI

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