N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxy-propanamide

Systemtic Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxy-propanamide Openeye Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(isopropylideneamino)oxy-propanamide CAS Name: N-[2-(1-benzotriazolylmethylthio)-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxypropanamide IUPAC Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxypropanamide Traditional Name: N-[2-(benzotriazol-1-ylmethylthio)-1,3-benzothiazol-6-yl]-2-(isopropylideneamino)oxy-propionamide Formula: C20H20N6O2S2 MolecularWeight: 440.5418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)SCN3C4=CC=CC=C4N=N3)ON=C(C)C

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)SCN3C4=CC=CC=C4N=N3)ON=C(C)C

InChI

InChI=1S/C20H20N6O2S2/c1-12(2)24-28-13(3)19(27)21-14-8-9-16-18(10-14)30-20(22-16)29-11-26-17-7-5-4-6-15(17)23-25-26/h4-10,13H,11H2,1-3H3,(H,21,27)