1-(1,3-dimethylpyrazol-4-yl)sulfonyl-4-(phenylmethyl)piperazine

Systemtic Name: 1-(1,3-dimethylpyrazol-4-yl)sulfonyl-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(1,3-dimethylpyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-[(1,3-dimethyl-4-pyrazolyl)sulfonyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-(1,3-dimethylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-benzyl-4-(1,3-dimethylpyrazol-4-yl)sulfonyl-piperazine Formula: C16H22N4O2S MolecularWeight: 334.43648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C16H22N4O2S/c1-14-16(13-18(2)17-14)23(21,22)20-10-8-19(9-11-20)12-15-6-4-3-5-7-15/h3-7,13H,8-12H2,1-2H3