5-chloranyl-N'-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoyl]-2-methoxy-benzohydrazide

Systemtic Name: 5-chloranyl-N'-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanoyl]-2-methoxy-benzohydrazide Openeye Name: 5-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]-2-methoxy-benzohydrazide CAS Name: 5-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-oxoethyl]-2-methoxybenzohydrazide IUPAC Name: 5-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]-2-methoxybenzohydrazide Traditional Name: 5-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)acetyl]-2-methoxy-benzohydrazide Formula: C19H20ClN3O3S MolecularWeight: 405.8984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=O)CN2CCCSC3=CC=CC=C32

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=O)CN2CCCSC3=CC=CC=C32

InChI

InChI=1S/C19H20ClN3O3S/c1-26-16-8-7-13(20)11-14(16)19(25)22-21-18(24)12-23-9-4-10-27-17-6-3-2-5-15(17)23/h2-3,5-8,11H,4,9-10,12H2,1H3,(H,21,24)(H,22,25)