2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide

Systemtic Name: 2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Openeye Name: 2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide CAS Name: 2-(methylthio)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Traditional Name: 2-(methylthio)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Formula: C18H18N4OS MolecularWeight: 338.42672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC=CC=C3SC

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC=CC=C3SC

InChI

InChI=1S/C18H18N4OS/c1-13(21-18(23)16-5-3-4-6-17(16)24-2)14-7-9-15(10-8-14)22-12-19-11-20-22/h3-13H,1-2H3,(H,21,23)