N-[2-[[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxidanylidene-ethoxy]benzamide

Systemtic Name: N-[2-[[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxidanylidene-ethoxy]benzamide Openeye Name: N-[2-[[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxo-ethoxy]benzamide CAS Name: N-[2-[[2-(1-benzotriazolylmethylthio)-1,3-benzothiazol-6-yl]amino]-2-oxoethoxy]benzamide IUPAC Name: N-[2-[[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxoethoxy]benzamide Traditional Name: N-[2-[[2-(benzotriazol-1-ylmethylthio)-1,3-benzothiazol-6-yl]amino]-2-keto-ethoxy]benzamide Formula: C23H18N6O3S2 MolecularWeight: 490.55742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NOCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NOCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H18N6O3S2/c30-21(13-32-27-22(31)15-6-2-1-3-7-15)24-16-10-11-18-20(12-16)34-23(25-18)33-14-29-19-9-5-4-8-17(19)26-28-29/h1-12H,13-14H2,(H,24,30)(H,27,31)