N-(3-azanyl-4-chloranyl-phenyl)-4-(2-hydroxyethylsulfanyl)butanamide

Systemtic Name: N-(3-azanyl-4-chloranyl-phenyl)-4-(2-hydroxyethylsulfanyl)butanamide Openeye Name: N-(3-amino-4-chloro-phenyl)-4-(2-hydroxyethylsulfanyl)butanamide CAS Name: N-(3-amino-4-chlorophenyl)-4-(2-hydroxyethylthio)butanamide IUPAC Name: N-(3-amino-4-chlorophenyl)-4-(2-hydroxyethylsulfanyl)butanamide Traditional Name: N-(3-amino-4-chloro-phenyl)-4-(2-hydroxyethylthio)butyramide Formula: C12H17ClN2O2S MolecularWeight: 288.79358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCCSCCO)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCCSCCO)N)Cl

InChI

InChI=1S/C12H17ClN2O2S/c13-10-4-3-9(8-11(10)14)15-12(17)2-1-6-18-7-5-16/h3-4,8,16H,1-2,5-7,14H2,(H,15,17)