N-[3-[[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[1-oxo-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetyl]amino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]methyl]phenyl]cyclopropanecarboxamide Formula: C18H23N5O2S MolecularWeight: 373.47252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCC2=CC(=CC=C2)NC(=O)C3CC3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCC2=CC(=CC=C2)NC(=O)C3CC3

InChI

InChI=1S/C18H23N5O2S/c1-2-4-15-21-22-18(26)23(15)11-16(24)19-10-12-5-3-6-14(9-12)20-17(25)13-7-8-13/h3,5-6,9,13H,2,4,7-8,10-11H2,1H3,(H,19,24)(H,20,25)(H,22,26)