N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(3-oxidanylidene-1H-2-benzofuran-1-yl)ethanamide

Systemtic Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(3-oxidanylidene-1H-2-benzofuran-1-yl)ethanamide Openeye Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(3-oxo-1H-isobenzofuran-1-yl)acetamide CAS Name: N-[2-(1-benzotriazolylmethylthio)-1,3-benzothiazol-6-yl]-2-(3-oxo-1H-isobenzofuran-1-yl)acetamide IUPAC Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(3-oxo-1H-2-benzofuran-1-yl)acetamide Traditional Name: N-[2-(benzotriazol-1-ylmethylthio)-1,3-benzothiazol-6-yl]-2-phthalidyl-acetamide Formula: C24H17N5O3S2 MolecularWeight: 487.55348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)CC(=O)NC3=CC4=C(C=C3)N=C(S4)SCN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C2C(=C1)C(OC2=O)CC(=O)NC3=CC4=C(C=C3)N=C(S4)SCN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C24H17N5O3S2/c30-22(12-20-15-5-1-2-6-16(15)23(31)32-20)25-14-9-10-18-21(11-14)34-24(26-18)33-13-29-19-8-4-3-7-17(19)27-28-29/h1-11,20H,12-13H2,(H,25,30)