methyl 4-[(2-chloranyl-5-methoxycarbonyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 4-[(2-chloranyl-5-methoxycarbonyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 4-(2-chloro-5-methoxycarbonyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(2-chloro-5-methoxycarbonylanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-chloro-5-methoxycarbonylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(5-carbomethoxy-2-chloro-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C17H14ClN3O4S MolecularWeight: 391.82876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=C(C=CC(=C3)C(=O)OC)Cl)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=C(C=CC(=C3)C(=O)OC)Cl)C(=O)OC

InChI

InChI=1S/C17H14ClN3O4S/c1-8-12-14(19-7-20-15(12)26-13(8)17(23)25-3)21-11-6-9(16(22)24-2)4-5-10(11)18/h4-7H,1-3H3,(H,19,20,21)