N-(3,4-dimethoxyphenyl)-2-[2-[(3-methylbutanoylamino)carbamoyl]phenyl]sulfanyl-ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[2-[(3-methylbutanoylamino)carbamoyl]phenyl]sulfanyl-ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[2-[(3-methylbutanoylamino)carbamoyl]phenyl]sulfanyl-acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[2-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]phenyl]thio]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[2-[(3-methylbutanoylamino)carbamoyl]phenyl]sulfanylacetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[2-[(isovalerylamino)carbamoyl]phenyl]thio]acetamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)CC(=O)NNC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H27N3O5S/c1-14(2)11-20(26)24-25-22(28)16-7-5-6-8-19(16)31-13-21(27)23-15-9-10-17(29-3)18(12-15)30-4/h5-10,12,14H,11,13H2,1-4H3,(H,23,27)(H,24,26)(H,25,28)