2-azanyl-6-phenylsulfanyl-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-phenylsulfanyl-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-phenylsulfanyl-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-(phenylthio)-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-phenylsulfanyl-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-(phenylthio)-4-(3,4,5-trimethoxyphenyl)dinicotinonitrile Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=C2C#N)SC3=CC=CC=C3)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=C2C#N)SC3=CC=CC=C3)N)C#N

InChI

InChI=1S/C22H18N4O3S/c1-27-17-9-13(10-18(28-2)20(17)29-3)19-15(11-23)21(25)26-22(16(19)12-24)30-14-7-5-4-6-8-14/h4-10H,1-3H3,(H2,25,26)