3-(4-methoxyphenyl)-2-prop-2-ynylsulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(4-methoxyphenyl)-2-prop-2-ynylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(4-methoxyphenyl)-2-prop-2-ynylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(4-methoxyphenyl)-2-(prop-2-ynylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(4-methoxyphenyl)-2-prop-2-ynylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-methoxyphenyl)-2-(propargylthio)thieno[2,3-d]pyrimidin-4-one Formula: C16H12N2O2S2 MolecularWeight: 328.40868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC#C)SC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC#C)SC=C3

InChI

InChI=1S/C16H12N2O2S2/c1-3-9-22-16-17-14-13(8-10-21-14)15(19)18(16)11-4-6-12(20-2)7-5-11/h1,4-8,10H,9H2,2H3