diethyl 5-azanyl-3-[(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-azanyl-3-[(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H19N3O5S3 MolecularWeight: 453.55556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CSC2=NC3=C(C=CS3)C(=O)N2C)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CSC2=NC3=C(C=CS3)C(=O)N2C)C(=O)OCC)N

InChI

InChI=1S/C18H19N3O5S3/c1-4-25-16(23)11-10(12(29-13(11)19)17(24)26-5-2)8-28-18-20-14-9(6-7-27-14)15(22)21(18)3/h6-7H,4-5,8,19H2,1-3H3