(2S)-N-(5-chloranyl-2-methyl-phenyl)-2-oxidanyl-pyrrolidine-1-carbothioamide

Systemtic Name: (2S)-N-(5-chloranyl-2-methyl-phenyl)-2-oxidanyl-pyrrolidine-1-carbothioamide Openeye Name: (2S)-N-(5-chloro-2-methyl-phenyl)-2-hydroxy-pyrrolidine-1-carbothioamide CAS Name: (2S)-N-(5-chloro-2-methylphenyl)-2-hydroxy-1-pyrrolidinecarbothioamide IUPAC Name: (2S)-N-(5-chloro-2-methylphenyl)-2-hydroxypyrrolidine-1-carbothioamide Traditional Name: (2S)-N-(5-chloro-2-methyl-phenyl)-2-hydroxy-pyrrolidine-1-carbothioamide Formula: C12H15ClN2OS MolecularWeight: 270.7783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)N2CCCC2O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)N2CCC[C@@H]2O

InChI

InChI=1S/C12H15ClN2OS/c1-8-4-5-9(13)7-10(8)14-12(17)15-6-2-3-11(15)16/h4-5,7,11,16H,2-3,6H2,1H3,(H,14,17)/t11-/m0/s1