2-azanyl-4-[(1S)-1-cyano-2-(3-methoxyphenyl)ethyl]-6-(diethylamino)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-[(1S)-1-cyano-2-(3-methoxyphenyl)ethyl]-6-(diethylamino)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-[(1S)-1-cyano-2-(3-methoxyphenyl)ethyl]-6-(diethylamino)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-[(1S)-1-cyano-2-(3-methoxyphenyl)ethyl]-6-(diethylamino)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-[(1S)-1-cyano-2-(3-methoxyphenyl)ethyl]-6-(diethylamino)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-[(1S)-1-cyano-2-(3-methoxyphenyl)ethyl]-6-(diethylamino)dinicotinonitrile Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=C(C(=N1)N)C#N)C(CC2=CC(=CC=C2)OC)C#N)C#N

Isomeric SMILES

CCN(CC)C1=C(C(=C(C(=N1)N)C#N)[C@H](CC2=CC(=CC=C2)OC)C#N)C#N

InChI

InChI=1S/C21H22N6O/c1-4-27(5-2)21-18(13-24)19(17(12-23)20(25)26-21)15(11-22)9-14-7-6-8-16(10-14)28-3/h6-8,10,15H,4-5,9H2,1-3H3,(H2,25,26)/t15-/m1/s1