methyl 5-methyl-4-[(4-pyrrolidin-1-ylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-methyl-4-[(4-pyrrolidin-1-ylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-methyl-4-(4-pyrrolidin-1-ylanilino)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[4-(1-pyrrolidinyl)anilino]-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-(4-pyrrolidin-1-ylanilino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-(4-pyrrolidinoanilino)thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C19H20N4O2S MolecularWeight: 368.4527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N4CCCC4)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N4CCCC4)C(=O)OC

InChI

InChI=1S/C19H20N4O2S/c1-12-15-17(20-11-21-18(15)26-16(12)19(24)25-2)22-13-5-7-14(8-6-13)23-9-3-4-10-23/h5-8,11H,3-4,9-10H2,1-2H3,(H,20,21,22)