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

Systemtic Name: ethyl 5-methyl-4-[(phenylmethyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(benzylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[(phenylmethyl)amino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(benzylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC=CC=C3)C

InChI

InChI=1S/C17H17N3O2S/c1-3-22-17(21)14-11(2)13-15(19-10-20-16(13)23-14)18-9-12-7-5-4-6-8-12/h4-8,10H,3,9H2,1-2H3,(H,18,19,20)