1-[(E)-2-(benzotriazol-1-yl)-1,2-bis(octylsulfanyl)ethenyl]benzotriazole

Systemtic Name: 1-[(E)-2-(benzotriazol-1-yl)-1,2-bis(octylsulfanyl)ethenyl]benzotriazole Openeye Name: 1-[(E)-2-(benzotriazol-1-yl)-1,2-bis(octylsulfanyl)vinyl]benzotriazole CAS Name: 1-[(E)-2-(1-benzotriazolyl)-1,2-bis(octylthio)ethenyl]benzotriazole IUPAC Name: 1-[(E)-2-(benzotriazol-1-yl)-1,2-bis(octylsulfanyl)ethenyl]benzotriazole Traditional Name: 1-[(E)-2-(benzotriazol-1-yl)-1,2-bis(octylthio)vinyl]benzotriazole Formula: C30H42N6S2 MolecularWeight: 550.82468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=C(N1C2=CC=CC=C2N=N1)SCCCCCCCC)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCCCCCCCS/C(=C(\N1C2=CC=CC=C2N=N1)/SCCCCCCCC)/N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C30H42N6S2/c1-3-5-7-9-11-17-23-37-29(35-27-21-15-13-19-25(27)31-33-35)30(38-24-18-12-10-8-6-4-2)36-28-22-16-14-20-26(28)32-34-36/h13-16,19-22H,3-12,17-18,23-24H2,1-2H3/b30-29+