6-chloranyl-N'-(phenylcarbonyl)benzo[b][1,4]benzothiazepine-3-carbohydrazide

Systemtic Name: 6-chloranyl-N'-(phenylcarbonyl)benzo[b][1,4]benzothiazepine-3-carbohydrazide Openeye Name: N'-benzoyl-6-chloro-benzo[b][1,4]benzothiazepine-3-carbohydrazide CAS Name: N'-benzoyl-6-chloro-3-benzo[b][1,4]benzothiazepinecarbohydrazide IUPAC Name: N'-benzoyl-6-chlorobenzo[b][1,4]benzothiazepine-3-carbohydrazide Traditional Name: N'-benzoyl-6-chloro-benzo[b][1,4]benzothiazepine-3-carbohydrazide Formula: C21H14ClN3O2S MolecularWeight: 407.87276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4C(=N3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4C(=N3)Cl

InChI

InChI=1S/C21H14ClN3O2S/c22-19-15-8-4-5-9-17(15)28-18-11-10-14(12-16(18)23-19)21(27)25-24-20(26)13-6-2-1-3-7-13/h1-12H,(H,24,26)(H,25,27)