(E)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)-N-(2-methyl-5-piperidinosulfonyl-phenyl)acrylamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N4O3S/c1-20-10-12-23(33(31,32)29-14-6-3-7-15-29)16-24(20)27-25(30)13-11-22-17-26-28(19-22)18-21-8-4-2-5-9-21/h2,4-5,8-13,16-17,19H,3,6-7,14-15,18H2,1H3,(H,27,30)/b13-11+