2-azanyl-4-(3-methoxy-4-phenylmethoxy-phenyl)-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(3-methoxy-4-phenylmethoxy-phenyl)-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-benzyloxy-3-methoxy-phenyl)-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(3-methoxy-4-phenylmethoxyphenyl)-6-(phenylthio)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(3-methoxy-4-phenylmethoxyphenyl)-6-phenylsulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-benzoxy-3-methoxy-phenyl)-6-(phenylthio)dinicotinonitrile Formula: C27H20N4O2S MolecularWeight: 464.5383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C(=NC(=C2C#N)SC3=CC=CC=C3)N)C#N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C(=NC(=C2C#N)SC3=CC=CC=C3)N)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C27H20N4O2S/c1-32-24-14-19(12-13-23(24)33-17-18-8-4-2-5-9-18)25-21(15-28)26(30)31-27(22(25)16-29)34-20-10-6-3-7-11-20/h2-14H,17H2,1H3,(H2,30,31)