2,5-dimethyl-4-[methyl-(phenylmethyl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 2,5-dimethyl-4-[methyl-(phenylmethyl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-[benzyl(methyl)amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2,5-dimethyl-4-[methyl-(phenylmethyl)amino]-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-[benzyl(methyl)amino]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-[benzyl(methyl)amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N(C)CC3=CC=CC=C3)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N(C)CC3=CC=CC=C3)C)C(=O)O

InChI

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