(2R)-N-(3-chloranyl-4-cyano-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(3-chloranyl-4-cyano-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(3-chloro-4-cyano-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(3-chloro-4-cyanophenyl)-2-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: (2R)-N-(3-chloro-4-cyanophenyl)-2-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(3-chloro-4-cyano-phenyl)-2-[(1-methylimidazol-2-yl)thio]propionamide Formula: C14H13ClN4OS MolecularWeight: 320.79722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)SC2=NC=CN2C

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)C#N)Cl)SC2=NC=CN2C

InChI

InChI=1S/C14H13ClN4OS/c1-9(21-14-17-5-6-19(14)2)13(20)18-11-4-3-10(8-16)12(15)7-11/h3-7,9H,1-2H3,(H,18,20)/t9-/m1/s1