N-phenyl-3-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]propanamide

Systemtic Name: N-phenyl-3-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]propanamide Openeye Name: N-phenyl-3-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]propanamide CAS Name: N-phenyl-3-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]propanamide IUPAC Name: N-phenyl-3-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]propanamide Traditional Name: N-phenyl-3-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]propionamide Formula: C17H17N4OS+ MolecularWeight: 325.40808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCSC2=[N+](NC=N2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCSC2=[N+](NC=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N4OS/c22-16(20-14-7-3-1-4-8-14)11-12-23-17-18-13-19-21(17)15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H,20,22)/p+1