(2R)-2-(benzotriazol-1-yl)-2-butylsulfanyl-1-(4-methylphenyl)ethanone

Systemtic Name: (2R)-2-(benzotriazol-1-yl)-2-butylsulfanyl-1-(4-methylphenyl)ethanone Openeye Name: (2R)-2-(benzotriazol-1-yl)-2-butylsulfanyl-1-(p-tolyl)ethanone CAS Name: (2R)-2-(1-benzotriazolyl)-2-(butylthio)-1-(4-methylphenyl)ethanone IUPAC Name: (2R)-2-(benzotriazol-1-yl)-2-butylsulfanyl-1-(4-methylphenyl)ethanone Traditional Name: (2R)-2-(benzotriazol-1-yl)-2-(butylthio)-1-(p-tolyl)ethanone Formula: C19H21N3OS MolecularWeight: 339.45454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(C(=O)C1=CC=C(C=C1)C)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCS[C@H](C(=O)C1=CC=C(C=C1)C)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H21N3OS/c1-3-4-13-24-19(18(23)15-11-9-14(2)10-12-15)22-17-8-6-5-7-16(17)20-21-22/h5-12,19H,3-4,13H2,1-2H3/t19-/m1/s1