N'-[4-(1,3-dithian-2-yl)phenyl]carbonyl-3-methyl-1-benzofuran-2-carbohydrazide

Systemtic Name: N'-[4-(1,3-dithian-2-yl)phenyl]carbonyl-3-methyl-1-benzofuran-2-carbohydrazide Openeye Name: N'-[4-(1,3-dithian-2-yl)benzoyl]-3-methyl-benzofuran-2-carbohydrazide CAS Name: N'-[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]-3-methyl-2-benzofurancarbohydrazide IUPAC Name: N'-[4-(1,3-dithian-2-yl)benzoyl]-3-methyl-1-benzofuran-2-carbohydrazide Traditional Name: N'-[4-(1,3-dithian-2-yl)benzoyl]-3-methyl-coumarilohydrazide Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)C4SCCCS4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C21H20N2O3S2/c1-13-16-5-2-3-6-17(16)26-18(13)20(25)23-22-19(24)14-7-9-15(10-8-14)21-27-11-4-12-28-21/h2-3,5-10,21H,4,11-12H2,1H3,(H,22,24)(H,23,25)