phenethyl 5-methyl-4-(quinolin-8-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 5-methyl-4-(quinolin-8-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 5-methyl-4-(8-quinolylamino)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(8-quinolinylamino)-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 5-methyl-4-(quinolin-8-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-(8-quinolylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC4=C3N=CC=C4)C(=O)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC4=C3N=CC=C4)C(=O)OCCC5=CC=CC=C5

InChI

InChI=1S/C25H20N4O2S/c1-16-20-23(29-19-11-5-9-18-10-6-13-26-21(18)19)27-15-28-24(20)32-22(16)25(30)31-14-12-17-7-3-2-4-8-17/h2-11,13,15H,12,14H2,1H3,(H,27,28,29)