N-[2,5-dimethoxy-4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]phenyl]benzamide

Systemtic Name: N-[2,5-dimethoxy-4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]phenyl]benzamide Openeye Name: N-[2,5-dimethoxy-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]phenyl]benzamide CAS Name: N-[2,5-dimethoxy-4-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]phenyl]benzamide IUPAC Name: N-[2,5-dimethoxy-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]phenyl]benzamide Traditional Name: N-[2,5-dimethoxy-4-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]phenyl]benzamide Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CSC3=NC=NN3

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C19H19N5O4S/c1-27-15-9-14(23-18(26)12-6-4-3-5-7-12)16(28-2)8-13(15)22-17(25)10-29-19-20-11-21-24-19/h3-9,11H,10H2,1-2H3,(H,22,25)(H,23,26)(H,20,21,24)