2-azanyl-6-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)thio]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)thio]-4-(3,4,5-trimethoxyphenyl)dinicotinonitrile Formula: C26H22N6O4S MolecularWeight: 514.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)SC3=C(C(=C(C(=N3)N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)SC3=C(C(=C(C(=N3)N)C#N)C4=CC(=C(C(=C4)OC)OC)OC)C#N

InChI

InChI=1S/C26H22N6O4S/c1-14-23(26(33)32(31-14)16-8-6-5-7-9-16)37-25-18(13-28)21(17(12-27)24(29)30-25)15-10-19(34-2)22(36-4)20(11-15)35-3/h5-11,31H,1-4H3,(H2,29,30)