6-methyl-2-phenacylsulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 6-methyl-2-phenacylsulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-2-phenacylsulfanyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-2-(phenacylthio)-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-2-phenacylsulfanyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-2-(phenacylthio)-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C19H18N2O2S2 MolecularWeight: 370.48842

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H18N2O2S2/c1-11-7-8-15-13(9-11)16-17(23)20-19(21-18(16)25-15)24-10-14(22)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,20,21,23)