(E)-N-[4-[4-[(3-methylphenyl)-phenyl-methyl]piperazin-1-yl]butyl]-3-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[4-[4-[(3-methylphenyl)-phenyl-methyl]piperazin-1-yl]butyl]-3-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-N-[4-[4-[m-tolyl(phenyl)methyl]piperazin-1-yl]butyl]-3-(3-pyridyl)prop-2-enamide CAS Name: (E)-N-[4-[4-[(3-methylphenyl)-phenylmethyl]-1-piperazinyl]butyl]-3-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[4-[4-[(3-methylphenyl)-phenylmethyl]piperazin-1-yl]butyl]-3-pyridin-3-ylprop-2-enamide Traditional Name: (E)-N-[4-[4-[m-tolyl(phenyl)methyl]piperazino]butyl]-3-(3-pyridyl)acrylamide Formula: C30H36N4O MolecularWeight: 468.63304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2)N3CCN(CC3)CCCCNC(=O)C=CC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2)N3CCN(CC3)CCCCNC(=O)/C=C/C4=CN=CC=C4

InChI

InChI=1S/C30H36N4O/c1-25-9-7-13-28(23-25)30(27-11-3-2-4-12-27)34-21-19-33(20-22-34)18-6-5-17-32-29(35)15-14-26-10-8-16-31-24-26/h2-4,7-16,23-24,30H,5-6,17-22H2,1H3,(H,32,35)/b15-14+