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

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(4-pyridyl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-pyridin-4-ylmethanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(4-pyridyl)methanone Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3S/c1-14-3-4-17(13-15(14)2)25(23,24)21-11-9-20(10-12-21)18(22)16-5-7-19-8-6-16/h3-8,13H,9-12H2,1-2H3