2-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]amino]-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(1-benzylpyrazol-4-yl)methyl-methylamino]-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(1-benzylpyrazol-4-yl)methyl-methyl-amino]-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C26H33N5O3S MolecularWeight: 495.63692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=CN(N=C2)CC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H33N5O3S/c1-21-11-12-24(15-25(21)35(33,34)31-13-7-4-8-14-31)28-26(32)20-29(2)17-23-16-27-30(19-23)18-22-9-5-3-6-10-22/h3,5-6,9-12,15-16,19H,4,7-8,13-14,17-18,20H2,1-2H3,(H,28,32)