5-methyl-4-oxidanylidene-2-sulfanylidene-3-(2-thiophen-2-ylethanoylamino)-1H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-4-oxidanylidene-2-sulfanylidene-3-(2-thiophen-2-ylethanoylamino)-1H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-4-oxo-3-[[2-(2-thienyl)acetyl]amino]-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[(1-oxo-2-thiophen-2-ylethyl)amino]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 5-methyl-4-oxo-2-sulfanylidene-3-[(2-thiophen-2-ylacetyl)amino]-1H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-[[2-(2-thienyl)acetyl]amino]-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C14H10N3O4S3- MolecularWeight: 380.4419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=S)N2)NC(=O)CC3=CC=CS3)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=S)N2)NC(=O)CC3=CC=CS3)C(=O)[O-]

InChI

InChI=1S/C14H11N3O4S3/c1-6-9-11(24-10(6)13(20)21)15-14(22)17(12(9)19)16-8(18)5-7-3-2-4-23-7/h2-4H,5H2,1H3,(H,15,22)(H,16,18)(H,20,21)/p-1