1-[(E)-5-(benzotriazol-1-yl)-3-(phenylsulfonyl)-2-(phenylsulfonylmethyl)pent-4-enyl]benzotriazole

Systemtic Name: 1-[(E)-5-(benzotriazol-1-yl)-3-(phenylsulfonyl)-2-(phenylsulfonylmethyl)pent-4-enyl]benzotriazole Openeye Name: 1-[(E)-3-(benzenesulfonyl)-2-(benzenesulfonylmethyl)-5-(benzotriazol-1-yl)pent-4-enyl]benzotriazole CAS Name: 1-[(E)-3-(benzenesulfonyl)-2-(benzenesulfonylmethyl)-5-(1-benzotriazolyl)pent-4-enyl]benzotriazole IUPAC Name: 1-[(E)-3-(benzenesulfonyl)-2-(benzenesulfonylmethyl)-5-(benzotriazol-1-yl)pent-4-enyl]benzotriazole Traditional Name: 1-[(E)-5-(benzotriazol-1-yl)-3-besyl-2-(besylmethyl)pent-4-enyl]benzotriazole Formula: C30H26N6O4S2 MolecularWeight: 598.69524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC(CN2C3=CC=CC=C3N=N2)C(C=CN4C5=CC=CC=C5N=N4)S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC(CN2C3=CC=CC=C3N=N2)C(/C=C/N4C5=CC=CC=C5N=N4)S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C30H26N6O4S2/c37-41(38,24-11-3-1-4-12-24)22-23(21-36-29-18-10-8-16-27(29)32-34-36)30(42(39,40)25-13-5-2-6-14-25)19-20-35-28-17-9-7-15-26(28)31-33-35/h1-20,23,30H,21-22H2/b20-19+