methyl 2-methyl-5-[[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-5-oxidanylidene-4-sulfanyl-pentanoate

Systemtic Name: methyl 2-methyl-5-[[4-methyl-1-[[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-5-oxidanylidene-4-sulfanyl-pentanoate Openeye Name: methyl 5-[[1-[[1-benzyl-2-(methylamino)-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-2-methyl-5-oxo-4-sulfanyl-pentanoate CAS Name: 4-mercapto-2-methyl-5-[[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 2-methyl-5-[[4-methyl-1-[[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-5-oxo-4-sulfanylpentanoate Traditional Name: 5-[[1-[[1-benzyl-2-keto-2-(methylamino)ethyl]carbamoyl]-3-methyl-butyl]amino]-5-keto-4-mercapto-2-methyl-valeric acid methyl ester Formula: C23H35N3O5S MolecularWeight: 465.6061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35N3O5S/c1-14(2)11-17(26-22(29)19(32)12-15(3)23(30)31-5)21(28)25-18(20(27)24-4)13-16-9-7-6-8-10-16/h6-10,14-15,17-19,32H,11-13H2,1-5H3,(H,24,27)(H,25,28)(H,26,29)