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

Systemtic Name: (E)-N-[4-[4-[(4-aminophenyl)-phenyl-methyl]piperazin-1-yl]butyl]-3-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-N-[4-[4-[(4-aminophenyl)-phenyl-methyl]piperazin-1-yl]butyl]-3-(3-pyridyl)prop-2-enamide CAS Name: (E)-N-[4-[4-[(4-aminophenyl)-phenylmethyl]-1-piperazinyl]butyl]-3-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[4-[4-[(4-aminophenyl)-phenylmethyl]piperazin-1-yl]butyl]-3-pyridin-3-ylprop-2-enamide Traditional Name: (E)-N-[4-[4-[(4-aminophenyl)-phenyl-methyl]piperazino]butyl]-3-(3-pyridyl)acrylamide Formula: C29H35N5O MolecularWeight: 469.6211

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C=CC2=CN=CC=C2)C(C3=CC=CC=C3)C4=CC=C(C=C4)N

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)/C=C/C2=CN=CC=C2)C(C3=CC=CC=C3)C4=CC=C(C=C4)N

InChI

InChI=1S/C29H35N5O/c30-27-13-11-26(12-14-27)29(25-8-2-1-3-9-25)34-21-19-33(20-22-34)18-5-4-17-32-28(35)15-10-24-7-6-16-31-23-24/h1-3,6-16,23,29H,4-5,17-22,30H2,(H,32,35)/b15-10+