N'-[(3-methyl-1-benzofuran-2-yl)carbonyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide

Systemtic Name: N'-[(3-methyl-1-benzofuran-2-yl)carbonyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide Openeye Name: N'-(3-methylbenzofuran-2-carbonyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide CAS Name: N'-[(3-methyl-2-benzofuranyl)-oxomethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide IUPAC Name: N'-(3-methyl-1-benzofuran-2-carbonyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide Traditional Name: 4-keto-N'-(3-methylbenzofuran-2-carbonyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carbohydrazide Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC4=C(C=C3)SCCC(=O)N4

InChI

InChI=1S/C20H17N3O4S/c1-11-13-4-2-3-5-15(13)27-18(11)20(26)23-22-19(25)12-6-7-16-14(10-12)21-17(24)8-9-28-16/h2-7,10H,8-9H2,1H3,(H,21,24)(H,22,25)(H,23,26)