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

Systemtic Name: (2S)-2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Openeye Name: (2S)-2-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate CAS Name: (2S)-2-[(6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]propanoate IUPAC Name: (2S)-2-(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Traditional Name: (2S)-2-[(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]propionate Formula: C16H13N2O2S2- MolecularWeight: 329.41662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN=C2SC(C)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(S1)N=CN=C2S[C@@H](C)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2S2/c1-9-12(11-6-4-3-5-7-11)13-14(21-9)17-8-18-15(13)22-10(2)16(19)20/h3-8,10H,1-2H3,(H,19,20)/p-1/t10-/m0/s1