N-(3-aminophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide

Systemtic Name: N-(3-aminophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Openeye Name: N-(3-aminophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide CAS Name: N-(3-aminophenyl)-3-(1H-1,2,4-triazol-5-ylthio)propanamide IUPAC Name: N-(3-aminophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Traditional Name: N-(3-aminophenyl)-3-(1H-1,2,4-triazol-5-ylthio)propionamide Formula: C11H13N5OS MolecularWeight: 263.31882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCSC2=NC=NN2)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCSC2=NC=NN2)N

InChI

InChI=1S/C11H13N5OS/c12-8-2-1-3-9(6-8)15-10(17)4-5-18-11-13-7-14-16-11/h1-3,6-7H,4-5,12H2,(H,15,17)(H,13,14,16)