N-[4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-2-(2-pyrrolidin-1-ylethanoylamino)pentanamide

Systemtic Name: N-[4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-2-(2-pyrrolidin-1-ylethanoylamino)pentanamide Openeye Name: N-[1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]-3-methyl-2-[(2-pyrrolidin-1-ylacetyl)amino]pentanamide CAS Name: N-[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-3-methyl-2-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]pentanamide IUPAC Name: N-[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-3-methyl-2-[(2-pyrrolidin-1-ylacetyl)amino]pentanamide Traditional Name: N-[1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]-3-methyl-2-[(2-pyrrolidinoacetyl)amino]valeramide Formula: C33H50N4O6S MolecularWeight: 630.8383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC(C)C)S(=O)(=O)C2=CC=C(C=C2)OC)O)NC(=O)CN3CCCC3

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC(C)C)S(=O)(=O)C2=CC=C(C=C2)OC)O)NC(=O)CN3CCCC3

InChI

InChI=1S/C33H50N4O6S/c1-6-25(4)32(35-31(39)23-36-18-10-11-19-36)33(40)34-29(20-26-12-8-7-9-13-26)30(38)22-37(21-24(2)3)44(41,42)28-16-14-27(43-5)15-17-28/h7-9,12-17,24-25,29-30,32,38H,6,10-11,18-23H2,1-5H3,(H,34,40)(H,35,39)