(2R)-N-(3-chloranyl-4-cyano-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide

Systemtic Name: (2R)-N-(3-chloranyl-4-cyano-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2R)-N-(3-chloro-4-cyano-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2R)-N-(3-chloro-4-cyanophenyl)-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2R)-N-(3-chloro-4-cyanophenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2R)-N-(3-chloro-4-cyano-phenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C16H11ClN4OS2 MolecularWeight: 374.86774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)SC2=NC=NC3=C2C=CS3

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)C#N)Cl)SC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C16H11ClN4OS2/c1-9(24-16-12-4-5-23-15(12)19-8-20-16)14(22)21-11-3-2-10(7-18)13(17)6-11/h2-6,8-9H,1H3,(H,21,22)/t9-/m1/s1