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

Systemtic Name: propan-2-yl 5-methyl-4-[(4-phenylazanylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 4-(4-anilinoanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(4-anilinoanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(4-anilinoanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(4-anilinoanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)NC4=CC=CC=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)NC4=CC=CC=C4)C(=O)OC(C)C

InChI

InChI=1S/C23H22N4O2S/c1-14(2)29-23(28)20-15(3)19-21(24-13-25-22(19)30-20)27-18-11-9-17(10-12-18)26-16-7-5-4-6-8-16/h4-14,26H,1-3H3,(H,24,25,27)