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

Systemtic Name: 3-[(6-cyclohexyloxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propanoate Openeye Name: 3-[[6-(cyclohexoxycarbonyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propanoate CAS Name: 3-[[6-[cyclohexyloxy(oxo)methyl]-5-methyl-4-thieno[2,3-d]pyrimidinyl]amino]propanoate IUPAC Name: 3-[(6-cyclohexyloxycarbonyl-5-methylthieno[2,3-d]pyrimidin-4-yl)amino]propanoate Traditional Name: 3-[[6-(cyclohexoxycarbonyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propionate Formula: C17H20N3O4S- MolecularWeight: 362.4234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC(=O)[O-])C(=O)OC3CCCCC3

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC(=O)[O-])C(=O)OC3CCCCC3

InChI

InChI=1S/C17H21N3O4S/c1-10-13-15(18-8-7-12(21)22)19-9-20-16(13)25-14(10)17(23)24-11-5-3-2-4-6-11/h9,11H,2-8H2,1H3,(H,21,22)(H,18,19,20)/p-1