5-(phenylsulfanylmethyl)-N'-(3,4,5-trimethoxyphenyl)carbonyl-furan-2-carbohydrazide

Systemtic Name: 5-(phenylsulfanylmethyl)-N'-(3,4,5-trimethoxyphenyl)carbonyl-furan-2-carbohydrazide Openeye Name: 5-(phenylsulfanylmethyl)-N'-(3,4,5-trimethoxybenzoyl)furan-2-carbohydrazide CAS Name: N'-[oxo-(3,4,5-trimethoxyphenyl)methyl]-5-[(phenylthio)methyl]-2-furancarbohydrazide IUPAC Name: 5-(phenylsulfanylmethyl)-N'-(3,4,5-trimethoxybenzoyl)furan-2-carbohydrazide Traditional Name: 5-[(phenylthio)methyl]-N'-(3,4,5-trimethoxybenzoyl)-2-furohydrazide Formula: C22H22N2O6S MolecularWeight: 442.48488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C2=CC=C(O2)CSC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C2=CC=C(O2)CSC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O6S/c1-27-18-11-14(12-19(28-2)20(18)29-3)21(25)23-24-22(26)17-10-9-15(30-17)13-31-16-7-5-4-6-8-16/h4-12H,13H2,1-3H3,(H,23,25)(H,24,26)