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

Systemtic Name: methyl 4-chloranyl-5-methyl-2-(phenylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-benzyl-4-chloro-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-chloro-5-methyl-2-(phenylmethyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-4-chloro-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-benzyl-4-chloro-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C16H13ClN2O2S MolecularWeight: 332.80462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)CC3=CC=CC=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)CC3=CC=CC=C3)Cl)C(=O)OC

InChI

InChI=1S/C16H13ClN2O2S/c1-9-12-14(17)18-11(8-10-6-4-3-5-7-10)19-15(12)22-13(9)16(20)21-2/h3-7H,8H2,1-2H3