tert-butyl 5-methyl-2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]hex-4-enoate

Systemtic Name: tert-butyl 5-methyl-2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]hex-4-enoate Openeye Name: tert-butyl 2-[[isobutyl(methylsulfonyl)amino]-(4-methylpentanoyl)amino]-5-methyl-hex-4-enoate CAS Name: 5-methyl-2-[(4-methyl-1-oxopentyl)-[2-methylpropyl(methylsulfonyl)amino]amino]-4-hexenoic acid tert-butyl ester IUPAC Name: tert-butyl 5-methyl-2-[4-methylpentanoyl-[2-methylpropyl(methylsulfonyl)amino]amino]hex-4-enoate Traditional Name: 2-[[isobutyl(mesyl)amino]-(4-methylpentanoyl)amino]-5-methyl-hex-4-enoic acid tert-butyl ester Formula: C22H42N2O5S MolecularWeight: 446.64428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N(C(CC=C(C)C)C(=O)OC(C)(C)C)N(CC(C)C)S(=O)(=O)C

Isomeric SMILES

CC(C)CCC(=O)N(C(CC=C(C)C)C(=O)OC(C)(C)C)N(CC(C)C)S(=O)(=O)C

InChI

InChI=1S/C22H42N2O5S/c1-16(2)11-13-19(21(26)29-22(7,8)9)24(20(25)14-12-17(3)4)23(15-18(5)6)30(10,27)28/h11,17-19H,12-15H2,1-10H3