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

Systemtic Name: methyl 3-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Openeye Name: methyl 3-(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate CAS Name: 3-[(2-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Traditional Name: 3-[(2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]propionic acid methyl ester Formula: C17H16N2O2S2 MolecularWeight: 344.45114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=N1)SCCC(=O)OC

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=N1)SCCC(=O)OC

InChI

InChI=1S/C17H16N2O2S2/c1-11-18-16(22-9-8-14(20)21-2)15-13(10-23-17(15)19-11)12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3