3-butylsulfanyl-5-phenyl-1-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-5-phenyl-1-(phenylmethyl)-1,2,4-triazole Openeye Name: 1-benzyl-3-butylsulfanyl-5-phenyl-1,2,4-triazole CAS Name: 3-(butylthio)-5-phenyl-1-(phenylmethyl)-1,2,4-triazole IUPAC Name: 1-benzyl-3-butylsulfanyl-5-phenyl-1,2,4-triazole Traditional Name: 1-benzyl-3-(butylthio)-5-phenyl-1,2,4-triazole Formula: C19H21N3S MolecularWeight: 323.45514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN(C(=N1)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCCSC1=NN(C(=N1)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H21N3S/c1-2-3-14-23-19-20-18(17-12-8-5-9-13-17)22(21-19)15-16-10-6-4-7-11-16/h4-13H,2-3,14-15H2,1H3