5,6-dimethyl-3-(4-nitrophenyl)carbonyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-(4-nitrophenyl)carbonyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-(4-nitrobenzoyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-[(4-nitrophenyl)-oxomethyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-3-(4-nitrobenzoyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-3-(4-nitrobenzoyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C15H11N3O4S2 MolecularWeight: 361.39554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=S)N2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=S)N2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C15H11N3O4S2/c1-7-8(2)24-12-11(7)14(20)17(15(23)16-12)13(19)9-3-5-10(6-4-9)18(21)22/h3-6H,1-2H3,(H,16,23)