N-(cyanomethyl)-2-[3-[4-(diphenacylamino)phenyl]phenyl]-4-methyl-pentanamide

Systemtic Name: N-(cyanomethyl)-2-[3-[4-(diphenacylamino)phenyl]phenyl]-4-methyl-pentanamide Openeye Name: N-(cyanomethyl)-2-[3-[4-(diphenacylamino)phenyl]phenyl]-4-methyl-pentanamide CAS Name: N-(cyanomethyl)-2-[3-[4-(diphenacylamino)phenyl]phenyl]-4-methylpentanamide IUPAC Name: N-(cyanomethyl)-2-[3-[4-(diphenacylamino)phenyl]phenyl]-4-methylpentanamide Traditional Name: N-(cyanomethyl)-2-[3-[4-(diphenacylamino)phenyl]phenyl]-4-methyl-valeramide Formula: C36H35N3O3 MolecularWeight: 557.6814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)N(CC(=O)C3=CC=CC=C3)CC(=O)C4=CC=CC=C4)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)N(CC(=O)C3=CC=CC=C3)CC(=O)C4=CC=CC=C4)C(=O)NCC#N

InChI

InChI=1S/C36H35N3O3/c1-26(2)22-33(36(42)38-21-20-37)31-15-9-14-30(23-31)27-16-18-32(19-17-27)39(24-34(40)28-10-5-3-6-11-28)25-35(41)29-12-7-4-8-13-29/h3-19,23,26,33H,21-22,24-25H2,1-2H3,(H,38,42)