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

Systemtic Name: 5-methyl-3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 5-methyl-3-phenyl-2-thioxo-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 5-methyl-3-phenyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 5-methyl-3-phenyl-2-thioxo-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C17H16N2OS2 MolecularWeight: 328.45174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2=C1C3=C(S2)NC(=S)N(C3=O)C4=CC=CC=C4

Isomeric SMILES

CC1CCCC2=C1C3=C(S2)NC(=S)N(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C17H16N2OS2/c1-10-6-5-9-12-13(10)14-15(22-12)18-17(21)19(16(14)20)11-7-3-2-4-8-11/h2-4,7-8,10H,5-6,9H2,1H3,(H,18,21)