6-ethyl-2-(2-oxidanylidenepropylsulfanyl)-3-phenethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-2-(2-oxidanylidenepropylsulfanyl)-3-phenethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-acetonylsulfanyl-6-ethyl-3-phenethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-2-(2-oxopropylthio)-3-phenethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-2-(2-oxopropylsulfanyl)-3-phenethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(acetonylthio)-6-ethyl-3-phenethyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H20N2O2S2 MolecularWeight: 372.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC(=O)C

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC(=O)C

InChI

InChI=1S/C19H20N2O2S2/c1-3-15-11-16-17(25-15)20-19(24-12-13(2)22)21(18(16)23)10-9-14-7-5-4-6-8-14/h4-8,11H,3,9-10,12H2,1-2H3