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

Systemtic Name: 4-[[2-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]butanoic acid Openeye Name: 4-[[2-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]butanoic acid CAS Name: 4-[[2-methyl-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]butanoic acid IUPAC Name: 4-[[2-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]butanoic acid Traditional Name: 4-[[2-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]butyric 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)NCCCC(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O2S/c1-11-5-7-13(8-6-11)14-10-24-18-16(14)17(20-12(2)21-18)19-9-3-4-15(22)23/h5-8,10H,3-4,9H2,1-2H3,(H,22,23)(H,19,20,21)