N-(1,3-benzodioxol-5-yl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]benzamide Formula: C18H15N5O4S MolecularWeight: 397.4078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3NC(=O)CSC4=NC=NN4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3NC(=O)CSC4=NC=NN4

InChI

InChI=1S/C18H15N5O4S/c24-16(8-28-18-19-9-20-23-18)22-13-4-2-1-3-12(13)17(25)21-11-5-6-14-15(7-11)27-10-26-14/h1-7,9H,8,10H2,(H,21,25)(H,22,24)(H,19,20,23)