5-[[4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[1-benzyl-2-hydroxy-3-[isopentyl-(4-methoxyphenyl)sulfonyl-amino]propyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-1-phenylbutan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 5-[[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]-1-phenylbutan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-[[1-benzyl-2-hydroxy-3-[isoamyl-(4-methoxyphenyl)sulfonyl-amino]propyl]amino]-5-keto-valeric acid Formula: C27H38N2O7S MolecularWeight: 534.66482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(C(CC1=CC=CC=C1)NC(=O)CCCC(=O)O)O)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CCN(CC(C(CC1=CC=CC=C1)NC(=O)CCCC(=O)O)O)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C27H38N2O7S/c1-20(2)16-17-29(37(34,35)23-14-12-22(36-3)13-15-23)19-25(30)24(18-21-8-5-4-6-9-21)28-26(31)10-7-11-27(32)33/h4-6,8-9,12-15,20,24-25,30H,7,10-11,16-19H2,1-3H3,(H,28,31)(H,32,33)