1-[(1E,6E)-4-methylsulfanyl-1,7-diphenyl-hepta-1,6-dien-4-yl]benzotriazole

Systemtic Name: 1-[(1E,6E)-4-methylsulfanyl-1,7-diphenyl-hepta-1,6-dien-4-yl]benzotriazole Openeye Name: 1-[(E)-1-[(E)-cinnamyl]-1-methylsulfanyl-4-phenyl-but-3-enyl]benzotriazole CAS Name: 1-[(1E,6E)-4-(methylthio)-1,7-diphenylhepta-1,6-dien-4-yl]benzotriazole IUPAC Name: 1-[(1E,6E)-4-methylsulfanyl-1,7-diphenylhepta-1,6-dien-4-yl]benzotriazole Traditional Name: 1-[(E)-1-[(E)-cinnamyl]-1-(methylthio)-4-phenyl-but-3-enyl]benzotriazole Formula: C26H25N3S MolecularWeight: 411.5618

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC=CC1=CC=CC=C1)(CC=CC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CSC(N1N=NC2=CC=CC=C12)(C/C=C/C3=CC=CC=C3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H25N3S/c1-30-26(20-10-16-22-12-4-2-5-13-22,21-11-17-23-14-6-3-7-15-23)29-25-19-9-8-18-24(25)27-28-29/h2-19H,20-21H2,1H3/b16-10+,17-11+