2-[(4-chlorophenyl)methylsulfanyl]-6-(3-methoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(3-methoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(3-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[(4-chlorophenyl)methylthio]-6-(3-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(3-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[(4-chlorobenzyl)thio]-4-keto-6-(3-methoxyphenyl)-1H-pyrimidine-5-carbonitrile Formula: C19H14ClN3O2S MolecularWeight: 383.85136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=O)N=C(N2)SCC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=O)N=C(N2)SCC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C19H14ClN3O2S/c1-25-15-4-2-3-13(9-15)17-16(10-21)18(24)23-19(22-17)26-11-12-5-7-14(20)8-6-12/h2-9H,11H2,1H3,(H,22,23,24)