methyl 2-[(2-azanyl-4-methylsulfonyl-butanoyl)amino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[(2-azanyl-4-methylsulfonyl-butanoyl)amino]-3-methyl-pentanoate Openeye Name: methyl 2-[(2-amino-4-methylsulfonyl-butanoyl)amino]-3-methyl-pentanoate CAS Name: 2-[(2-amino-4-methylsulfonyl-1-oxobutyl)amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(2-amino-4-methylsulfonylbutanoyl)amino]-3-methylpentanoate Traditional Name: 2-[(2-amino-4-mesyl-butanoyl)amino]-3-methyl-valeric acid methyl ester Formula: C12H24N2O5S MolecularWeight: 308.39436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C(CCS(=O)(=O)C)N

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)C(CCS(=O)(=O)C)N

InChI

InChI=1S/C12H24N2O5S/c1-5-8(2)10(12(16)19-3)14-11(15)9(13)6-7-20(4,17)18/h8-10H,5-7,13H2,1-4H3,(H,14,15)