3-phenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: 3-phenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: 3-phenyl-N-(5-thioxo-1H-1,2,4-triazol-4-yl)propanamide CAS Name: 3-phenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: 3-phenyl-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: 3-phenyl-N-(5-thioxo-1H-1,2,4-triazol-4-yl)propionamide Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NN2C=NNC2=S

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NN2C=NNC2=S

InChI

InChI=1S/C11H12N4OS/c16-10(14-15-8-12-13-11(15)17)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,13,17)(H,14,16)