4-(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)benzoic acid

Systemtic Name: 4-(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)benzoic acid Openeye Name: 4-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)benzoic acid CAS Name: 4-(4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)benzoic acid IUPAC Name: 4-(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)benzoic acid Traditional Name: 4-(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)benzoic acid Formula: C15H13N3O2S MolecularWeight: 299.34762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O2S/c1-7-8(2)21-14-11(7)12(16)17-13(18-14)9-3-5-10(6-4-9)15(19)20/h3-6H,1-2H3,(H,19,20)(H2,16,17,18)