4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[(1E)-1-pyrrol-2-ylideneethyl]benzohydrazide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[(1E)-1-pyrrol-2-ylideneethyl]benzohydrazide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[(1E)-1-pyrrol-2-ylideneethyl]benzohydrazide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N'-[(1E)-1-(2-pyrrolylidene)ethyl]benzohydrazide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[(1E)-1-pyrrol-2-ylideneethyl]benzohydrazide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N'-[(1E)-1-pyrrol-2-ylideneethyl]benzohydrazide Formula: C21H18N4OS2 MolecularWeight: 406.52382

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC=N1)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C/C(=C\1/C=CC=N1)/NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N4OS2/c1-14(17-6-4-12-22-17)24-25-20(26)16-10-8-15(9-11-16)13-27-21-23-18-5-2-3-7-19(18)28-21/h2-12,24H,13H2,1H3,(H,25,26)/b17-14+