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

Systemtic Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone Openeye Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone CAS Name: [4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-(1-phenyl-4-pyrazolyl)methanone IUPAC Name: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-(1-phenylpyrazol-4-yl)methanone Traditional Name: [4-(3,4-dimethylphenyl)sulfonylpiperazino]-(1-phenylpyrazol-4-yl)methanone Formula: C22H24N4O3S MolecularWeight: 424.51596

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=CN(N=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H24N4O3S/c1-17-8-9-21(14-18(17)2)30(28,29)25-12-10-24(11-13-25)22(27)19-15-23-26(16-19)20-6-4-3-5-7-20/h3-9,14-16H,10-13H2,1-2H3