6-(4-chlorophenyl)-4-oxidanylidene-2-prop-2-enylsulfanyl-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)-4-oxidanylidene-2-prop-2-enylsulfanyl-1H-pyrimidine-5-carbonitrile Openeye Name: 2-allylsulfanyl-6-(4-chlorophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-chlorophenyl)-4-oxo-2-(prop-2-enylthio)-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-chlorophenyl)-4-oxo-2-prop-2-enylsulfanyl-1H-pyrimidine-5-carbonitrile Traditional Name: 2-(allylthio)-6-(4-chlorophenyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C14H10ClN3OS MolecularWeight: 303.7667

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

C=CCSC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C14H10ClN3OS/c1-2-7-20-14-17-12(11(8-16)13(19)18-14)9-3-5-10(15)6-4-9/h2-6H,1,7H2,(H,17,18,19)