1-[(E)-2-(4-methylphenyl)-1-phenyl-3-phenylsulfanyl-prop-1-enyl]benzotriazole

Systemtic Name: 1-[(E)-2-(4-methylphenyl)-1-phenyl-3-phenylsulfanyl-prop-1-enyl]benzotriazole Openeye Name: 1-[(E)-1-phenyl-3-phenylsulfanyl-2-(p-tolyl)prop-1-enyl]benzotriazole CAS Name: 1-[(E)-2-(4-methylphenyl)-1-phenyl-3-(phenylthio)prop-1-enyl]benzotriazole IUPAC Name: 1-[(E)-2-(4-methylphenyl)-1-phenyl-3-phenylsulfanylprop-1-enyl]benzotriazole Traditional Name: 1-[(E)-1-phenyl-3-(phenylthio)-2-(p-tolyl)prop-1-enyl]benzotriazole Formula: C28H23N3S MolecularWeight: 433.56732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)N3C4=CC=CC=C4N=N3)CSC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\N3C4=CC=CC=C4N=N3)/CSC5=CC=CC=C5

InChI

InChI=1S/C28H23N3S/c1-21-16-18-22(19-17-21)25(20-32-24-12-6-3-7-13-24)28(23-10-4-2-5-11-23)31-27-15-9-8-14-26(27)29-30-31/h2-19H,20H2,1H3/b28-25-