propan-2-yl 5-methyl-4-[(4-phenylmethoxyphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl 5-methyl-4-[(4-phenylmethoxyphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 4-(4-benzyloxyanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(4-phenylmethoxyanilino)-6-thieno[2,3-d]pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-methyl-4-(4-phenylmethoxyanilino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(4-benzoxyanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C24H23N3O3S MolecularWeight: 433.52272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)OC(C)C

InChI

InChI=1S/C24H23N3O3S/c1-15(2)30-24(28)21-16(3)20-22(25-14-26-23(20)31-21)27-18-9-11-19(12-10-18)29-13-17-7-5-4-6-8-17/h4-12,14-15H,13H2,1-3H3,(H,25,26,27)