N'-[2-(2-cyanophenoxy)ethanoyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide

Systemtic Name: N'-[2-(2-cyanophenoxy)ethanoyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide Openeye Name: N'-[2-(2-cyanophenoxy)acetyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide CAS Name: N'-[2-(2-cyanophenoxy)-1-oxoethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide IUPAC Name: N'-[2-(2-cyanophenoxy)acetyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide Traditional Name: N'-[2-(2-cyanophenoxy)acetyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NNC(=O)COC3=CC=CC=C3C#N)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NNC(=O)COC3=CC=CC=C3C#N)NC1=O

InChI

InChI=1S/C19H16N4O4S/c20-10-13-3-1-2-4-15(13)27-11-18(25)22-23-19(26)12-5-6-16-14(9-12)21-17(24)7-8-28-16/h1-6,9H,7-8,11H2,(H,21,24)(H,22,25)(H,23,26)