4-[[5-methyl-6-(2-methylpropoxycarbonyl)thieno[2,3-d]pyrimidin-4-yl]amino]butanoic acid

Systemtic Name: 4-[[5-methyl-6-(2-methylpropoxycarbonyl)thieno[2,3-d]pyrimidin-4-yl]amino]butanoic acid Openeye Name: 4-[(6-isobutoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]butanoic acid CAS Name: 4-[[5-methyl-6-[2-methylpropoxy(oxo)methyl]-4-thieno[2,3-d]pyrimidinyl]amino]butanoic acid IUPAC Name: 4-[[5-methyl-6-(2-methylpropoxycarbonyl)thieno[2,3-d]pyrimidin-4-yl]amino]butanoic acid Traditional Name: 4-[(6-isobutoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]butyric acid Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCCC(=O)O)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCCC(=O)O)C(=O)OCC(C)C

InChI

InChI=1S/C16H21N3O4S/c1-9(2)7-23-16(22)13-10(3)12-14(17-6-4-5-11(20)21)18-8-19-15(12)24-13/h8-9H,4-7H2,1-3H3,(H,20,21)(H,17,18,19)