(2-azanyl-2-oxidanylidene-ethyl) 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate Openeye Name: (2-amino-2-oxo-ethyl) 2-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]acetic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]acetic acid (2-amino-2-keto-ethyl) ester Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC(=O)OCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC(=O)OCC(=O)N

InChI

InChI=1S/C17H15N3O3S2/c1-10-2-4-11(5-3-10)12-7-24-16-15(12)17(20-9-19-16)25-8-14(22)23-6-13(18)21/h2-5,7,9H,6,8H2,1H3,(H2,18,21)