ethyl 2-azanyl-4-(2-phenylpropan-2-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(2-phenylpropan-2-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-amino-4-[(1-methyl-1-phenyl-ethyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-amino-4-(2-phenylpropan-2-ylamino)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(2-phenylpropan-2-ylamino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-amino-4-(cumylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N=C(N=C2S1)N)NC(C)(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC2=C(N=C(N=C2S1)N)NC(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O2S/c1-4-24-16(23)13-10-12-14(20-17(19)21-15(12)25-13)22-18(2,3)11-8-6-5-7-9-11/h5-10H,4H2,1-3H3,(H3,19,20,21,22)