6-(3-methoxy-4-phenylmethoxy-phenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(3-methoxy-4-phenylmethoxy-phenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-benzyloxy-3-methoxy-phenyl)-4-oxo-2-thioxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(3-methoxy-4-phenylmethoxyphenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(3-methoxy-4-phenylmethoxyphenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-benzoxy-3-methoxy-phenyl)-4-keto-2-thioxo-1H-pyrimidine-5-carbonitrile Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C(=O)NC(=S)N2)C#N)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C(=O)NC(=S)N2)C#N)OCC3=CC=CC=C3

InChI

InChI=1S/C19H15N3O3S/c1-24-16-9-13(17-14(10-20)18(23)22-19(26)21-17)7-8-15(16)25-11-12-5-3-2-4-6-12/h2-9H,11H2,1H3,(H2,21,22,23,26)