N-[3-(3-butylsulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl)phenyl]ethanamide

Systemtic Name: N-[3-(3-butylsulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl)phenyl]ethanamide Openeye Name: N-[3-(3-butylsulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl)phenyl]acetamide CAS Name: N-[3-[3-(butylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-(3-butylsulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl)phenyl]acetamide Traditional Name: N-[3-[3-(butylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C17H22N4OS MolecularWeight: 330.44778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)C3CC3

Isomeric SMILES

CCCCSC1=NN=C(N1C2=CC(=CC=C2)NC(=O)C)C3CC3

InChI

InChI=1S/C17H22N4OS/c1-3-4-10-23-17-20-19-16(13-8-9-13)21(17)15-7-5-6-14(11-15)18-12(2)22/h5-7,11,13H,3-4,8-10H2,1-2H3,(H,18,22)