N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-3-methyl-2-(2-methylpropyl)-4-oxidanylidene-3-sulfanyl-pentanamide

Systemtic Name: N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]-3-methyl-2-(2-methylpropyl)-4-oxidanylidene-3-sulfanyl-pentanamide Openeye Name: 2-isobutyl-N-[1-[(4-methoxyphenyl)methyl]-2-(methylamino)-2-oxo-ethyl]-3-methyl-4-oxo-3-sulfanyl-pentanamide CAS Name: 3-mercapto-N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxopropan-2-yl]-3-methyl-2-(2-methylpropyl)-4-oxopentanamide IUPAC Name: N-[3-(4-methoxyphenyl)-1-(methylamino)-1-oxopropan-2-yl]-3-methyl-2-(2-methylpropyl)-4-oxo-3-sulfanylpentanamide Traditional Name: 2-isobutyl-4-keto-N-[2-keto-2-(methylamino)-1-p-anisyl-ethyl]-3-mercapto-3-methyl-valeramide Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O4S/c1-13(2)11-17(21(4,28)14(3)24)19(25)23-18(20(26)22-5)12-15-7-9-16(27-6)10-8-15/h7-10,13,17-18,28H,11-12H2,1-6H3,(H,22,26)(H,23,25)