(2S)-2-[6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate

Systemtic Name: (2S)-2-[6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate Openeye Name: (2S)-2-[6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate CAS Name: (2S)-2-[[6-methyl-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]propanoate IUPAC Name: (2S)-2-[6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoate Traditional Name: (2S)-2-[[6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]propionate Formula: C17H15N2O2S2- MolecularWeight: 343.4432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=NC=N3)SC(C)C(=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=NC=N3)S[C@@H](C)C(=O)[O-])C

InChI

InChI=1S/C17H16N2O2S2/c1-9-4-6-12(7-5-9)13-10(2)22-15-14(13)16(19-8-18-15)23-11(3)17(20)21/h4-8,11H,1-3H3,(H,20,21)/p-1/t11-/m0/s1