N'-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]-5-bromanyl-thiophene-2-carbohydrazide

Systemtic Name: N'-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]-5-bromanyl-thiophene-2-carbohydrazide Openeye Name: N'-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]-5-bromo-thiophene-2-carbohydrazide CAS Name: N'-[4-(1,3-benzothiazol-2-ylthio)-1-oxobutyl]-5-bromo-2-thiophenecarbohydrazide IUPAC Name: N'-[4-(1,3-benzothiazol-2-ylsulfanyl)butanoyl]-5-bromothiophene-2-carbohydrazide Traditional Name: N'-[4-(1,3-benzothiazol-2-ylthio)butanoyl]-5-bromo-thiophene-2-carbohydrazide Formula: C16H14BrN3O2S3 MolecularWeight: 456.40026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NNC(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCCCC(=O)NNC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H14BrN3O2S3/c17-13-8-7-12(24-13)15(22)20-19-14(21)6-3-9-23-16-18-10-4-1-2-5-11(10)25-16/h1-2,4-5,7-8H,3,6,9H2,(H,19,21)(H,20,22)