2-azanyl-4-[4-[(4-methylsulfanylphenyl)amino]phenyl]-6-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-[(4-methylsulfanylphenyl)amino]phenyl]-6-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-[4-(4-methylsulfanylanilino)phenyl]-6-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-[4-[4-(methylthio)anilino]phenyl]-6-(3,4,5-trimethoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-[4-(4-methylsulfanylanilino)phenyl]-6-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-[4-[4-(methylthio)anilino]phenyl]-6-(3,4,5-trimethoxyphenyl)nicotinonitrile Formula: C28H26N4O3S MolecularWeight: 498.59604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC(=C(C(=C2)C3=CC=C(C=C3)NC4=CC=C(C=C4)SC)C#N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC(=C(C(=C2)C3=CC=C(C=C3)NC4=CC=C(C=C4)SC)C#N)N

InChI

InChI=1S/C28H26N4O3S/c1-33-25-13-18(14-26(34-2)27(25)35-3)24-15-22(23(16-29)28(30)32-24)17-5-7-19(8-6-17)31-20-9-11-21(36-4)12-10-20/h5-15,31H,1-4H3,(H2,30,32)