3-(3-chloranyl-4-methyl-phenyl)-7-methyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-7-methyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-(3-chloro-4-methyl-phenyl)-7-methyl-2-thioxo-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-(3-chloro-4-methylphenyl)-7-methyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-(3-chloro-4-methylphenyl)-7-methyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-chloro-4-methyl-phenyl)-7-methyl-2-thioxo-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C18H17ClN2OS2 MolecularWeight: 376.92338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)C4=CC(=C(C=C4)C)Cl

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)C4=CC(=C(C=C4)C)Cl

InChI

InChI=1S/C18H17ClN2OS2/c1-9-3-6-12-14(7-9)24-16-15(12)17(22)21(18(23)20-16)11-5-4-10(2)13(19)8-11/h4-5,8-9H,3,6-7H2,1-2H3,(H,20,23)