4-(4-methoxyphenyl)-6-oxidanylidene-1-prop-2-enyl-2-prop-2-enylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-methoxyphenyl)-6-oxidanylidene-1-prop-2-enyl-2-prop-2-enylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 1-allyl-2-allylsulfanyl-4-(4-methoxyphenyl)-6-oxo-pyrimidine-5-carbonitrile CAS Name: 4-(4-methoxyphenyl)-6-oxo-1-prop-2-enyl-2-(prop-2-enylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-methoxyphenyl)-6-oxo-1-prop-2-enyl-2-prop-2-enylsulfanylpyrimidine-5-carbonitrile Traditional Name: 1-allyl-2-(allylthio)-6-keto-4-(4-methoxyphenyl)pyrimidine-5-carbonitrile Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N(C(=N2)SCC=C)CC=C)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N(C(=N2)SCC=C)CC=C)C#N

InChI

InChI=1S/C18H17N3O2S/c1-4-10-21-17(22)15(12-19)16(20-18(21)24-11-5-2)13-6-8-14(23-3)9-7-13/h4-9H,1-2,10-11H2,3H3