3-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide

Systemtic Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide Openeye Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide CAS Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide IUPAC Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide Traditional Name: 3-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)CC2=C(C=CC(=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC(=C4)C#N)OC

Isomeric SMILES

CN1CCCN(CC1)CC2=C(C=CC(=C2)C3=CC(=CC=C3)NC(=O)C4=CC=CC(=C4)C#N)OC

InChI

InChI=1S/C28H30N4O2/c1-31-12-5-13-32(15-14-31)20-25-17-23(10-11-27(25)34-2)22-7-4-9-26(18-22)30-28(33)24-8-3-6-21(16-24)19-29/h3-4,6-11,16-18H,5,12-15,20H2,1-2H3,(H,30,33)