1-(benzotriazol-1-yl)-3-[3-(benzotriazol-1-yl)-3-oxidanylidene-propyl]sulfanyl-propan-1-one

Systemtic Name: 1-(benzotriazol-1-yl)-3-[3-(benzotriazol-1-yl)-3-oxidanylidene-propyl]sulfanyl-propan-1-one Openeye Name: 1-(benzotriazol-1-yl)-3-[3-(benzotriazol-1-yl)-3-oxo-propyl]sulfanyl-propan-1-one CAS Name: 1-(1-benzotriazolyl)-3-[[3-(1-benzotriazolyl)-3-oxopropyl]thio]-1-propanone IUPAC Name: 1-(benzotriazol-1-yl)-3-[3-(benzotriazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one Traditional Name: 1-(benzotriazol-1-yl)-3-[[3-(benzotriazol-1-yl)-3-keto-propyl]thio]propan-1-one Formula: C18H16N6O2S MolecularWeight: 380.42364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=O)CCSCCC(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(=O)CCSCCC(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H16N6O2S/c25-17(23-15-7-3-1-5-13(15)19-21-23)9-11-27-12-10-18(26)24-16-8-4-2-6-14(16)20-22-24/h1-8H,9-12H2