3-[(4-aminophenyl)sulfonyl-[6-(3,3-diphenylpropanoylamino)-1-oxidanyl-hexan-2-yl]amino]-2-methyl-propanamide

Systemtic Name: 3-[(4-aminophenyl)sulfonyl-[6-(3,3-diphenylpropanoylamino)-1-oxidanyl-hexan-2-yl]amino]-2-methyl-propanamide Openeye Name: 3-[(4-aminophenyl)sulfonyl-[5-(3,3-diphenylpropanoylamino)-1-(hydroxymethyl)pentyl]amino]-2-methyl-propanamide CAS Name: 3-[(4-aminophenyl)sulfonyl-[1-hydroxy-6-[(1-oxo-3,3-diphenylpropyl)amino]hexan-2-yl]amino]-2-methylpropanamide IUPAC Name: 3-[(4-aminophenyl)sulfonyl-[6-(3,3-diphenylpropanoylamino)-1-hydroxyhexan-2-yl]amino]-2-methylpropanamide Traditional Name: 3-[[5-(3,3-diphenylpropanoylamino)-1-methylol-pentyl]-sulfanilyl-amino]-2-methyl-propionamide Formula: C31H40N4O5S MolecularWeight: 580.7381

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C(CCCCNC(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CO)S(=O)(=O)C3=CC=C(C=C3)N)C(=O)N

Isomeric SMILES

CC(CN(C(CCCCNC(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2)CO)S(=O)(=O)C3=CC=C(C=C3)N)C(=O)N

InChI

InChI=1S/C31H40N4O5S/c1-23(31(33)38)21-35(41(39,40)28-17-15-26(32)16-18-28)27(22-36)14-8-9-19-34-30(37)20-29(24-10-4-2-5-11-24)25-12-6-3-7-13-25/h2-7,10-13,15-18,23,27,29,36H,8-9,14,19-22,32H2,1H3,(H2,33,38)(H,34,37)