(2S)-N-(3-cyanothiophen-2-yl)-2-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(3-cyanothiophen-2-yl)-2-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(3-cyano-2-thienyl)-2-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide CAS Name: (2S)-N-(3-cyano-2-thiophenyl)-2-[(2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(3-cyanothiophen-2-yl)-2-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanamide Traditional Name: (2S)-N-(3-cyano-2-thienyl)-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]propionamide Formula: C21H16N4OS3 MolecularWeight: 436.57294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=N1)SC(C)C(=O)NC4=C(C=CS4)C#N

Isomeric SMILES

CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=N1)S[C@@H](C)C(=O)NC4=C(C=CS4)C#N

InChI

InChI=1S/C21H16N4OS3/c1-12(18(26)25-19-15(11-22)8-9-27-19)28-20-16-10-17(14-6-4-3-5-7-14)29-21(16)24-13(2)23-20/h3-10,12H,1-2H3,(H,25,26)/t12-/m0/s1