(E)-N-[6-[4-(4-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[6-[4-(4-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[6-[4-(4-methylbenzoyl)piperazin-1-yl]-3-pyridyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[6-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[6-[4-(4-methylbenzoyl)piperazin-1-yl]pyridin-3-yl]-3-phenylprop-2-enamide Traditional Name: (E)-3-phenyl-N-[6-(4-p-toluoylpiperazino)-3-pyridyl]acrylamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O2/c1-20-7-10-22(11-8-20)26(32)30-17-15-29(16-18-30)24-13-12-23(19-27-24)28-25(31)14-9-21-5-3-2-4-6-21/h2-14,19H,15-18H2,1H3,(H,28,31)/b14-9+