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

Systemtic Name: 3-[methyl-[5-methyl-6-(2-methylpropoxycarbonyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Openeye Name: 3-[(6-isobutoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)-methyl-amino]propanoate CAS Name: 3-[methyl-[5-methyl-6-[2-methylpropoxy(oxo)methyl]-4-thieno[2,3-d]pyrimidinyl]amino]propanoate IUPAC Name: 3-[methyl-[5-methyl-6-(2-methylpropoxycarbonyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Traditional Name: 3-[(6-isobutoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)-methyl-amino]propionate Formula: C16H20N3O4S- MolecularWeight: 350.4127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N(C)CCC(=O)[O-])C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N(C)CCC(=O)[O-])C(=O)OCC(C)C

InChI

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