N-[2,7-dimethyl-8-(2-methylpropylamino)-5,6-bis(oxidanyl)-8-oxidanylidene-octan-4-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2,7-dimethyl-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)-4-methyl-5-oxo-pentyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[5,6-dihydroxy-2,7-dimethyl-8-(2-methylpropylamino)-8-oxooctan-4-yl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[5,6-dihydroxy-2,7-dimethyl-8-(2-methylpropylamino)-8-oxooctan-4-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2,3-dihydroxy-1-isobutyl-5-(isobutylamino)-5-keto-4-methyl-pentyl]-4-pyrrolidinosulfonyl-benzamide Formula: C25H41N3O6S MolecularWeight: 511.67454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H41N3O6S/c1-16(2)14-21(23(30)22(29)18(5)24(31)26-15-17(3)4)27-25(32)19-8-10-20(11-9-19)35(33,34)28-12-6-7-13-28/h8-11,16-18,21-23,29-30H,6-7,12-15H2,1-5H3,(H,26,31)(H,27,32)