(4S)-4-[bis(phenylmethyl)amino]-3-oxidanylidene-5-(4-pyridin-2-ylphenyl)pentanenitrile

Systemtic Name: (4S)-4-[bis(phenylmethyl)amino]-3-oxidanylidene-5-(4-pyridin-2-ylphenyl)pentanenitrile Openeye Name: (4S)-4-(dibenzylamino)-3-oxo-5-[4-(2-pyridyl)phenyl]pentanenitrile CAS Name: (4S)-4-[bis(phenylmethyl)amino]-3-oxo-5-[4-(2-pyridinyl)phenyl]pentanenitrile IUPAC Name: (4S)-4-(dibenzylamino)-3-oxo-5-(4-pyridin-2-ylphenyl)pentanenitrile Traditional Name: (4S)-4-(dibenzylamino)-3-keto-5-[4-(2-pyridyl)phenyl]valeronitrile Formula: C30H27N3O MolecularWeight: 445.55488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(CC3=CC=C(C=C3)C4=CC=CC=N4)C(=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)[C@@H](CC3=CC=C(C=C3)C4=CC=CC=N4)C(=O)CC#N

InChI

InChI=1S/C30H27N3O/c31-19-18-30(34)29(21-24-14-16-27(17-15-24)28-13-7-8-20-32-28)33(22-25-9-3-1-4-10-25)23-26-11-5-2-6-12-26/h1-17,20,29H,18,21-23H2/t29-/m0/s1