N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonyl-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonyl-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]-1,3-benzodioxole-5-carbohydrazide Formula: C23H17N3O4S2 MolecularWeight: 463.52878

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H17N3O4S2/c27-21(25-26-22(28)16-9-10-18-19(11-16)30-13-29-18)15-7-5-14(6-8-15)12-31-23-24-17-3-1-2-4-20(17)32-23/h1-11H,12-13H2,(H,25,27)(H,26,28)