N-[1-[2-(3,4-dimethoxyphenyl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[1-[2-(3,4-dimethoxyphenyl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[1-[[(3,4-dimethoxybenzoyl)amino]carbamoyl]-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[1-[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[1-[2-(3,4-dimethoxybenzoyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[3-(methylthio)-1-[(veratroylamino)carbamoyl]propyl]-2-phenoxy-acetamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2)OC

InChI

InChI=1S/C22H27N3O6S/c1-29-18-10-9-15(13-19(18)30-2)21(27)24-25-22(28)17(11-12-32-3)23-20(26)14-31-16-7-5-4-6-8-16/h4-10,13,17H,11-12,14H2,1-3H3,(H,23,26)(H,24,27)(H,25,28)