6-phenyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1H-pyridine-3-carbonitrile

Systemtic Name: 6-phenyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1H-pyridine-3-carbonitrile Openeye Name: 6-phenyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1H-pyridine-3-carbonitrile CAS Name: 6-phenyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1H-pyridine-3-carbonitrile IUPAC Name: 6-phenyl-2-sulfanylidene-4-(3,4,5-trimethoxyphenyl)-1H-pyridine-3-carbonitrile Traditional Name: 6-phenyl-2-thioxo-4-(3,4,5-trimethoxyphenyl)-1H-pyridine-3-carbonitrile Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O3S/c1-24-18-9-14(10-19(25-2)20(18)26-3)15-11-17(13-7-5-4-6-8-13)23-21(27)16(15)12-22/h4-11H,1-3H3,(H,23,27)