4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[3-(4-methoxyphenyl)propanoyl]benzohydrazide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[3-(4-methoxyphenyl)propanoyl]benzohydrazide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[3-(4-methoxyphenyl)propanoyl]benzohydrazide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N'-[3-(4-methoxyphenyl)-1-oxopropyl]benzohydrazide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[3-(4-methoxyphenyl)propanoyl]benzohydrazide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N'-[3-(4-methoxyphenyl)propanoyl]benzohydrazide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H23N3O3S2/c1-31-20-13-8-17(9-14-20)10-15-23(29)27-28-24(30)19-11-6-18(7-12-19)16-32-25-26-21-4-2-3-5-22(21)33-25/h2-9,11-14H,10,15-16H2,1H3,(H,27,29)(H,28,30)