N-[3-methyl-1-[[4-[2-methylpropyl(methylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-3-methylsulfonyl-1-oxidanylidene-butan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: N-[3-methyl-1-[[4-[2-methylpropyl(methylsulfonyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-3-methylsulfonyl-1-oxidanylidene-butan-2-yl]pyrrolidine-2-carboxamide Openeye Name: N-[1-[[1-benzyl-2-hydroxy-3-[isobutyl(methylsulfonyl)amino]propyl]carbamoyl]-2-methyl-2-methylsulfonyl-propyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[[3-hydroxy-4-[2-methylpropyl(methylsulfonyl)amino]-1-phenylbutan-2-yl]amino]-3-methyl-3-methylsulfonyl-1-oxobutan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[[3-hydroxy-4-[2-methylpropyl(methylsulfonyl)amino]-1-phenylbutan-2-yl]amino]-3-methyl-3-methylsulfonyl-1-oxobutan-2-yl]pyrrolidine-2-carboxamide Traditional Name: N-[1-[[1-benzyl-2-hydroxy-3-[isobutyl(mesyl)amino]propyl]carbamoyl]-2-mesyl-2-methyl-propyl]pyrrolidine-2-carboxamide Formula: C26H44N4O7S2 MolecularWeight: 588.78016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)C(C(C)(C)S(=O)(=O)C)NC(=O)C2CCCN2)O)S(=O)(=O)C

Isomeric SMILES

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)C(C(C)(C)S(=O)(=O)C)NC(=O)C2CCCN2)O)S(=O)(=O)C

InChI

InChI=1S/C26H44N4O7S2/c1-18(2)16-30(39(6,36)37)17-22(31)21(15-19-11-8-7-9-12-19)28-25(33)23(26(3,4)38(5,34)35)29-24(32)20-13-10-14-27-20/h7-9,11-12,18,20-23,27,31H,10,13-17H2,1-6H3,(H,28,33)(H,29,32)