ethyl 5-methyl-4-oxidanylidene-3-prop-2-enyl-2-prop-2-enylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-prop-2-enyl-2-prop-2-enylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-allyl-2-allylsulfanyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-prop-2-enyl-2-(prop-2-enylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-3-prop-2-enyl-2-prop-2-enylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-allyl-2-(allylthio)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H18N2O3S2 MolecularWeight: 350.45572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC=C)SCC=C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC=C)SCC=C)C

InChI

InChI=1S/C16H18N2O3S2/c1-5-8-18-14(19)11-10(4)12(15(20)21-7-3)23-13(11)17-16(18)22-9-6-2/h5-6H,1-2,7-9H2,3-4H3