2-methyl-2-[[2-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoic acid

Systemtic Name: 2-methyl-2-[[2-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoic acid Openeye Name: 2-methyl-2-[[2-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoic acid CAS Name: 2-methyl-2-[[2-methyl-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]propanoic acid IUPAC Name: 2-methyl-2-[[2-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoic acid Traditional Name: 2-methyl-2-[[2-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]propionic acid Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)NC(C)(C)C(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)NC(C)(C)C(=O)O)C

InChI

InChI=1S/C18H19N3O2S/c1-10-5-7-12(8-6-10)13-9-24-16-14(13)15(19-11(2)20-16)21-18(3,4)17(22)23/h5-9H,1-4H3,(H,22,23)(H,19,20,21)