N-(3-azanylpropyl)-4-cyano-N-[[3-[2-(4-methoxyphenyl)ethanoylamino]phenyl]methyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-4-cyano-N-[[3-[2-(4-methoxyphenyl)ethanoylamino]phenyl]methyl]benzamide Openeye Name: N-(3-aminopropyl)-4-cyano-N-[[3-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]methyl]benzamide CAS Name: N-(3-aminopropyl)-4-cyano-N-[[3-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]phenyl]methyl]benzamide IUPAC Name: N-(3-aminopropyl)-4-cyano-N-[[3-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]methyl]benzamide Traditional Name: N-(3-aminopropyl)-4-cyano-N-[3-[[2-(4-methoxyphenyl)acetyl]amino]benzyl]benzamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H28N4O3/c1-34-25-12-8-20(9-13-25)17-26(32)30-24-5-2-4-22(16-24)19-31(15-3-14-28)27(33)23-10-6-21(18-29)7-11-23/h2,4-13,16H,3,14-15,17,19,28H2,1H3,(H,30,32)