(3R)-5-methyl-3-[[methylcarbamoyl(phenethyl)amino]carbamoyl]-N-oxidanyl-2-prop-2-enyl-hexanamide

Systemtic Name: (3R)-5-methyl-3-[[methylcarbamoyl(phenethyl)amino]carbamoyl]-N-oxidanyl-2-prop-2-enyl-hexanamide Openeye Name: 1-[[(2R)-3-(hydroxycarbamoyl)-2-isobutyl-hex-5-enoyl]amino]-3-methyl-1-phenethyl-urea CAS Name: (3R)-N-hydroxy-5-methyl-3-[[2-(methylcarbamoyl)-2-phenethylhydrazinyl]-oxomethyl]-2-prop-2-enylhexanamide IUPAC Name: (3R)-N-hydroxy-5-methyl-3-[[methylcarbamoyl(phenethyl)amino]carbamoyl]-2-prop-2-enylhexanamide Traditional Name: 1-[[(2R)-3-(hydroxycarbamoyl)-2-isobutyl-hex-5-enoyl]amino]-3-methyl-1-phenethyl-urea Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC=C)C(=O)NO)C(=O)NN(CCC1=CC=CC=C1)C(=O)NC

Isomeric SMILES

CC(C)C[C@H](C(CC=C)C(=O)NO)C(=O)NN(CCC1=CC=CC=C1)C(=O)NC

InChI

InChI=1S/C21H32N4O4/c1-5-9-17(20(27)24-29)18(14-15(2)3)19(26)23-25(21(28)22-4)13-12-16-10-7-6-8-11-16/h5-8,10-11,15,17-18,29H,1,9,12-14H2,2-4H3,(H,22,28)(H,23,26)(H,24,27)/t17?,18-/m1/s1