3-[(4-aminophenyl)sulfonyl-[5-(3-naphthalen-1-ylpropanoylamino)-1-oxidanyl-pentan-2-yl]amino]-2-methyl-propanamide

Systemtic Name: 3-[(4-aminophenyl)sulfonyl-[5-(3-naphthalen-1-ylpropanoylamino)-1-oxidanyl-pentan-2-yl]amino]-2-methyl-propanamide Openeye Name: 3-[(4-aminophenyl)sulfonyl-[1-(hydroxymethyl)-4-[3-(1-naphthyl)propanoylamino]butyl]amino]-2-methyl-propanamide CAS Name: 3-[(4-aminophenyl)sulfonyl-[1-hydroxy-5-[[3-(1-naphthalenyl)-1-oxopropyl]amino]pentan-2-yl]amino]-2-methylpropanamide IUPAC Name: 3-[(4-aminophenyl)sulfonyl-[1-hydroxy-5-(3-naphthalen-1-ylpropanoylamino)pentan-2-yl]amino]-2-methylpropanamide Traditional Name: 2-methyl-3-[[1-methylol-4-[3-(1-naphthyl)propanoylamino]butyl]-sulfanilyl-amino]propionamide Formula: C28H36N4O5S MolecularWeight: 540.67424

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C(CCCNC(=O)CCC1=CC=CC2=CC=CC=C21)CO)S(=O)(=O)C3=CC=C(C=C3)N)C(=O)N

Isomeric SMILES

CC(CN(C(CCCNC(=O)CCC1=CC=CC2=CC=CC=C21)CO)S(=O)(=O)C3=CC=C(C=C3)N)C(=O)N

InChI

InChI=1S/C28H36N4O5S/c1-20(28(30)35)18-32(38(36,37)25-14-12-23(29)13-15-25)24(19-33)9-5-17-31-27(34)16-11-22-8-4-7-21-6-2-3-10-26(21)22/h2-4,6-8,10,12-15,20,24,33H,5,9,11,16-19,29H2,1H3,(H2,30,35)(H,31,34)