1-[(2S)-2-methylsulfanyl-1-phenyl-hexan-2-yl]benzotriazole

Systemtic Name: 1-[(2S)-2-methylsulfanyl-1-phenyl-hexan-2-yl]benzotriazole Openeye Name: 1-[(1S)-1-benzyl-1-methylsulfanyl-pentyl]benzotriazole CAS Name: 1-[(2S)-2-(methylthio)-1-phenylhexan-2-yl]benzotriazole IUPAC Name: 1-[(2S)-2-methylsulfanyl-1-phenylhexan-2-yl]benzotriazole Traditional Name: 1-[(1S)-1-benzyl-1-(methylthio)pentyl]benzotriazole Formula: C19H23N3S MolecularWeight: 325.47102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=CC=C1)(N2C3=CC=CC=C3N=N2)SC

Isomeric SMILES

CCCC[C@](CC1=CC=CC=C1)(N2C3=CC=CC=C3N=N2)SC

InChI

InChI=1S/C19H23N3S/c1-3-4-14-19(23-2,15-16-10-6-5-7-11-16)22-18-13-9-8-12-17(18)20-21-22/h5-13H,3-4,14-15H2,1-2H3/t19-/m0/s1