N'-[3-(1,3-benzothiazol-2-yl)propanoyl]-3-pyrrolidin-1-ylsulfonyl-benzohydrazide

Systemtic Name: N'-[3-(1,3-benzothiazol-2-yl)propanoyl]-3-pyrrolidin-1-ylsulfonyl-benzohydrazide Openeye Name: N'-[3-(1,3-benzothiazol-2-yl)propanoyl]-3-pyrrolidin-1-ylsulfonyl-benzohydrazide CAS Name: N'-[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]-3-(1-pyrrolidinylsulfonyl)benzohydrazide IUPAC Name: N'-[3-(1,3-benzothiazol-2-yl)propanoyl]-3-pyrrolidin-1-ylsulfonylbenzohydrazide Traditional Name: N'-[3-(1,3-benzothiazol-2-yl)propanoyl]-3-pyrrolidinosulfonyl-benzohydrazide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N4O4S2/c26-19(10-11-20-22-17-8-1-2-9-18(17)30-20)23-24-21(27)15-6-5-7-16(14-15)31(28,29)25-12-3-4-13-25/h1-2,5-9,14H,3-4,10-13H2,(H,23,26)(H,24,27)