ethyl 4-azanyl-5-methyl-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-azanyl-5-methyl-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-5-methyl-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-5-methyl-2-[[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-5-methyl-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-5-methyl-2-[[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]methyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H17N5O2S4 MolecularWeight: 475.63058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CSC3=NN(C(=S)S3)C4=CC=CC=C4)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CSC3=NN(C(=S)S3)C4=CC=CC=C4)N)C

InChI

InChI=1S/C19H17N5O2S4/c1-3-26-17(25)14-10(2)13-15(20)21-12(22-16(13)29-14)9-28-18-23-24(19(27)30-18)11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H2,20,21,22)