2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide

Systemtic Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide Openeye Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide CAS Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-propylpropanamide IUPAC Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propylpropanamide Traditional Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-propyl-propionamide Formula: C14H17ClN4OS MolecularWeight: 324.82898

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NN=CN1C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCNC(=O)C(C)SC1=NN=CN1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H17ClN4OS/c1-3-7-16-13(20)10(2)21-14-18-17-9-19(14)12-6-4-5-11(15)8-12/h4-6,8-10H,3,7H2,1-2H3,(H,16,20)