4-methyl-3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid

Systemtic Name: 4-methyl-3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid Openeye Name: 4-methyl-3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid CAS Name: 4-methyl-3-[(2,5,6-trimethyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoic acid IUPAC Name: 4-methyl-3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid Traditional Name: 4-methyl-3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=C3C(=C(SC3=NC(=N2)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=C3C(=C(SC3=NC(=N2)C)C)C

InChI

InChI=1S/C17H17N3O2S/c1-8-5-6-12(17(21)22)7-13(8)20-15-14-9(2)10(3)23-16(14)19-11(4)18-15/h5-7H,1-4H3,(H,21,22)(H,18,19,20)