2-azanyl-6-phenylsulfanyl-4-quinolin-4-yl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-phenylsulfanyl-4-quinolin-4-yl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-phenylsulfanyl-4-(4-quinolyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-(phenylthio)-4-(4-quinolinyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-phenylsulfanyl-4-quinolin-4-ylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-(phenylthio)-4-(4-quinolyl)dinicotinonitrile Formula: C22H13N5S MolecularWeight: 379.43712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=NC4=CC=CC=C34)C#N

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=NC4=CC=CC=C34)C#N

InChI

InChI=1S/C22H13N5S/c23-12-17-20(16-10-11-26-19-9-5-4-8-15(16)19)18(13-24)22(27-21(17)25)28-14-6-2-1-3-7-14/h1-11H,(H2,25,27)