N-[2-methyl-8-(2-methylpropylamino)-5,6-bis(oxidanyl)-8-oxidanylidene-octan-4-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-methyl-8-(2-methylpropylamino)-5,6-bis(oxidanyl)-8-oxidanylidene-octan-4-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2,3-dihydroxy-1-isobutyl-5-(isobutylamino)-5-oxo-pentyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[5,6-dihydroxy-2-methyl-8-(2-methylpropylamino)-8-oxooctan-4-yl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[5,6-dihydroxy-2-methyl-8-(2-methylpropylamino)-8-oxooctan-4-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2,3-dihydroxy-1-isobutyl-5-(isobutylamino)-5-keto-pentyl]-4-pyrrolidinosulfonyl-benzamide Formula: C24H39N3O6S MolecularWeight: 497.64796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(CC(=O)NCC(C)C)O)O)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)CC(C(C(CC(=O)NCC(C)C)O)O)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C24H39N3O6S/c1-16(2)13-20(23(30)21(28)14-22(29)25-15-17(3)4)26-24(31)18-7-9-19(10-8-18)34(32,33)27-11-5-6-12-27/h7-10,16-17,20-21,23,28,30H,5-6,11-15H2,1-4H3,(H,25,29)(H,26,31)