N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-2-(3-oxidanylidene-2-sulfanyl-butan-2-yl)octanamide

Systemtic Name: N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-2-(3-oxidanylidene-2-sulfanyl-butan-2-yl)octanamide Openeye Name: N-[1-[(4-methoxyphenyl)methyl]-2-(methylamino)-2-oxo-ethyl]-2-(1-methyl-2-oxo-1-sulfanyl-propyl)octanamide CAS Name: 2-(2-mercapto-3-oxobutan-2-yl)-N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxopropan-2-yl]octanamide IUPAC Name: N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxopropan-2-yl]-2-(3-oxo-2-sulfanylbutan-2-yl)octanamide Traditional Name: 2-(2-keto-1-mercapto-1-methyl-propyl)-N-[2-keto-2-(methylamino)-1-p-anisyl-ethyl]caprylamide Formula: C23H36N2O4S MolecularWeight: 436.60794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)NC(CC1=CC=C(C=C1)OC)C(=O)NC)C(C)(C(=O)C)S

Isomeric SMILES

CCCCCCC(C(=O)NC(CC1=CC=C(C=C1)OC)C(=O)NC)C(C)(C(=O)C)S

InChI

InChI=1S/C23H36N2O4S/c1-6-7-8-9-10-19(23(3,30)16(2)26)21(27)25-20(22(28)24-4)15-17-11-13-18(29-5)14-12-17/h11-14,19-20,30H,6-10,15H2,1-5H3,(H,24,28)(H,25,27)