2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-chlorophenyl)propanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-chlorophenyl)propanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-chlorophenyl)propanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(4-chlorophenyl)propanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-(4-chlorophenyl)propanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-(4-chlorophenyl)propionamide Formula: C12H14ClN5OS MolecularWeight: 311.79046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Cl)N2C(=NN=C2SC)N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Cl)N2C(=NN=C2SC)N

InChI

InChI=1S/C12H14ClN5OS/c1-7(18-11(14)16-17-12(18)20-2)10(19)15-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H2,14,16)(H,15,19)