methyl 5-azanyl-4-(4-methoxyphenyl)-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-azanyl-4-(4-methoxyphenyl)-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-amino-4-(4-methoxyphenyl)-2-methylsulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-4-(4-methoxyphenyl)-2-(methylthio)-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-4-(4-methoxyphenyl)-2-methylsulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-4-(4-methoxyphenyl)-2-(methylthio)thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C(=C(SC3=NC(=N2)SC)C(=O)OC)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C(=C(SC3=NC(=N2)SC)C(=O)OC)N

InChI

InChI=1S/C16H15N3O3S2/c1-21-9-6-4-8(5-7-9)12-10-11(17)13(15(20)22-2)24-14(10)19-16(18-12)23-3/h4-7H,17H2,1-3H3