[1,1-bis(oxidanylidene)-1-benzothiophen-2-yl]methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: [1,1-bis(oxidanylidene)-1-benzothiophen-2-yl]methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (1,1-dioxobenzothiophen-2-yl)methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (1,1-dioxo-1-benzothiophen-2-yl)methyl ester IUPAC Name: (1,1-dioxo-1-benzothiophen-2-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (1,1-diketobenzothiophen-2-yl)methyl ester Formula: C15H14N2O4S2 MolecularWeight: 350.41266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC2=CC3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC2=CC3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C15H14N2O4S2/c1-9-12(7-16-15(22)17-9)14(18)21-8-11-6-10-4-2-3-5-13(10)23(11,19)20/h2-6H,7-8H2,1H3,(H2,16,17,22)