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

Systemtic Name: phenethyl 4-[(4-dimethylaminophenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 4-[4-(dimethylamino)anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-(dimethylamino)anilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 4-[4-(dimethylamino)anilino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(dimethylamino)anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N(C)C)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N(C)C)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C24H24N4O2S/c1-16-20-22(27-18-9-11-19(12-10-18)28(2)3)25-15-26-23(20)31-21(16)24(29)30-14-13-17-7-5-4-6-8-17/h4-12,15H,13-14H2,1-3H3,(H,25,26,27)