5-[4-(4-cyano-5-methyl-4-phenyl-hexyl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-(4-cyano-5-methyl-4-phenyl-hexyl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-(4-cyano-5-methyl-4-phenyl-hexyl)-1,4-diazepan-1-yl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[4-(4-cyano-5-methyl-4-phenylhexyl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-(4-cyano-5-methyl-4-phenylhexyl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[4-(4-cyano-5-methyl-4-phenyl-hexyl)-1,4-diazepan-1-yl]-2-isopropyl-2-phenyl-valeronitrile Formula: C33H46N4 MolecularWeight: 498.74514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCCN(CC1)CCCC(C#N)(C2=CC=CC=C2)C(C)C)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCCN(CC1)CCCC(C#N)(C2=CC=CC=C2)C(C)C)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C33H46N4/c1-28(2)32(26-34,30-14-7-5-8-15-30)18-11-20-36-22-13-23-37(25-24-36)21-12-19-33(27-35,29(3)4)31-16-9-6-10-17-31/h5-10,14-17,28-29H,11-13,18-25H2,1-4H3