cyclohexyl 4-[(3-acetamidophenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: cyclohexyl 4-[(3-acetamidophenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 4-(3-acetamidoanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(3-acetamidoanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-(3-acetamidoanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(3-acetamidoanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC(=CC=C3)NC(=O)C)C(=O)OC4CCCCC4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC(=CC=C3)NC(=O)C)C(=O)OC4CCCCC4

InChI

InChI=1S/C22H24N4O3S/c1-13-18-20(26-16-8-6-7-15(11-16)25-14(2)27)23-12-24-21(18)30-19(13)22(28)29-17-9-4-3-5-10-17/h6-8,11-12,17H,3-5,9-10H2,1-2H3,(H,25,27)(H,23,24,26)