methyl 7-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]heptanoate

Systemtic Name: methyl 7-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]heptanoate Openeye Name: methyl 7-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]heptanoate CAS Name: 7-[[2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]heptanoate Traditional Name: 7-[[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]enanthic acid methyl ester Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)NCCCCCCC(=O)OC)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)NCCCCCCC(=O)OC)C

InChI

InChI=1S/C18H25N3O3S2/c1-12-13(2)26-18-16(12)17(20-11-21-18)25-10-14(22)19-9-7-5-4-6-8-15(23)24-3/h11H,4-10H2,1-3H3,(H,19,22)