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

Systemtic Name: 4-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide Openeye Name: 4-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide CAS Name: 4-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide IUPAC Name: 4-cyano-N-[3-[4-methoxy-3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]phenyl]benzamide Traditional Name: 4-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=C(C=C4)C#N)OC

Isomeric SMILES

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

InChI

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