N,2-dimethyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N,2-dimethyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N,2-dimethyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N,2-dimethyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N,2-dimethyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-N,2-dimethyl-5-piperidinosulfonyl-benzamide Formula: C25H30N4O3S MolecularWeight: 466.5957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N(C)CC3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)N(C)CC3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O3S/c1-20-11-12-23(33(31,32)29-13-7-4-8-14-29)15-24(20)25(30)27(2)17-22-16-26-28(19-22)18-21-9-5-3-6-10-21/h3,5-6,9-12,15-16,19H,4,7-8,13-14,17-18H2,1-2H3