1-[(E,1R)-1-methylsulfanyl-4-phenyl-but-3-enyl]benzotriazole

Systemtic Name: 1-[(E,1R)-1-methylsulfanyl-4-phenyl-but-3-enyl]benzotriazole Openeye Name: 1-[(E,1R)-1-methylsulfanyl-4-phenyl-but-3-enyl]benzotriazole CAS Name: 1-[(E,1R)-1-(methylthio)-4-phenylbut-3-enyl]benzotriazole IUPAC Name: 1-[(E,1R)-1-methylsulfanyl-4-phenylbut-3-enyl]benzotriazole Traditional Name: 1-[(E,1R)-1-(methylthio)-4-phenyl-but-3-enyl]benzotriazole Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC=CC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CS[C@H](C/C=C/C1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H17N3S/c1-21-17(13-7-10-14-8-3-2-4-9-14)20-16-12-6-5-11-15(16)18-19-20/h2-12,17H,13H2,1H3/b10-7+/t17-/m1/s1