ethyl 3,5-dimethyl-4-oxidanylidene-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-oxidanylidene-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-oxo-2-thioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate CAS Name: 3,5-dimethyl-4-oxo-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-oxo-2-sulfanylidene-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylate Traditional Name: 4-keto-3,5-dimethyl-2-thioxo-1H-pyrrolo[3,2-d]pyrimidine-7-carboxylic acid ethyl ester Formula: C11H13N3O3S MolecularWeight: 267.30422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C1NC(=S)N(C2=O)C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C1NC(=S)N(C2=O)C)C

InChI

InChI=1S/C11H13N3O3S/c1-4-17-10(16)6-5-13(2)8-7(6)12-11(18)14(3)9(8)15/h5H,4H2,1-3H3,(H,12,18)