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

Systemtic Name: 1-(1,3-dimethylpyrazol-4-yl)sulfonyl-4-(phenylmethyl)piperidine Openeye Name: 4-benzyl-1-(1,3-dimethylpyrazol-4-yl)sulfonyl-piperidine CAS Name: 1-[(1,3-dimethyl-4-pyrazolyl)sulfonyl]-4-(phenylmethyl)piperidine IUPAC Name: 4-benzyl-1-(1,3-dimethylpyrazol-4-yl)sulfonylpiperidine Traditional Name: 4-benzyl-1-(1,3-dimethylpyrazol-4-yl)sulfonyl-piperidine Formula: C17H23N3O2S MolecularWeight: 333.44842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C=C1S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C17H23N3O2S/c1-14-17(13-19(2)18-14)23(21,22)20-10-8-16(9-11-20)12-15-6-4-3-5-7-15/h3-7,13,16H,8-12H2,1-2H3