1-[(E)-1,2-diphenyl-3-phenylsulfanyl-prop-1-enyl]benzotriazole

Systemtic Name: 1-[(E)-1,2-diphenyl-3-phenylsulfanyl-prop-1-enyl]benzotriazole Openeye Name: 1-[(E)-1,2-diphenyl-3-phenylsulfanyl-prop-1-enyl]benzotriazole CAS Name: 1-[(E)-1,2-diphenyl-3-(phenylthio)prop-1-enyl]benzotriazole IUPAC Name: 1-[(E)-1,2-diphenyl-3-phenylsulfanylprop-1-enyl]benzotriazole Traditional Name: 1-[(E)-1,2-diphenyl-3-(phenylthio)prop-1-enyl]benzotriazole Formula: C27H21N3S MolecularWeight: 419.54074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H21N3S/c1-4-12-21(13-5-1)24(20-31-23-16-8-3-9-17-23)27(22-14-6-2-7-15-22)30-26-19-11-10-18-25(26)28-29-30/h1-19H,20H2/b27-24-