3-[phenyl-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]propanamide

Systemtic Name: 3-[phenyl-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]amino]propanamide Openeye Name: 3-(N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]anilino)propanamide CAS Name: 3-(N-[1-oxo-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]ethyl]anilino)propanamide IUPAC Name: 3-(N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]anilino)propanamide Traditional Name: 3-(N-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetyl]anilino)propionamide Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)N(CCC(=O)N)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)N(CCC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C19H19N5O2S/c20-16(25)11-12-24(15-9-5-2-6-10-15)17(26)13-27-19-21-18(22-23-19)14-7-3-1-4-8-14/h1-10H,11-13H2,(H2,20,25)(H,21,22,23)