2-azanyl-N-[4-[2,3-dihydro-1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-pentanamide

Systemtic Name: 2-azanyl-N-[4-[2,3-dihydro-1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-methyl-pentanamide Openeye Name: 2-amino-N-[1-benzyl-3-[2,3-dihydrobenzofuran-5-ylsulfonyl(isobutyl)amino]-2-hydroxy-propyl]-3-methyl-pentanamide CAS Name: 2-amino-N-[4-[2,3-dihydrobenzofuran-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-3-methylpentanamide IUPAC Name: 2-amino-N-[4-[2,3-dihydro-1-benzofuran-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]-3-methylpentanamide Traditional Name: 2-amino-N-[1-benzyl-3-[coumaran-5-ylsulfonyl(isobutyl)amino]-2-hydroxy-propyl]-3-methyl-valeramide Formula: C28H41N3O5S MolecularWeight: 531.70724

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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=CC3=C(C=C2)OCC3)O)N

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC(C)C)S(=O)(=O)C2=CC3=C(C=C2)OCC3)O)N

InChI

InChI=1S/C28H41N3O5S/c1-5-20(4)27(29)28(33)30-24(15-21-9-7-6-8-10-21)25(32)18-31(17-19(2)3)37(34,35)23-11-12-26-22(16-23)13-14-36-26/h6-12,16,19-20,24-25,27,32H,5,13-15,17-18,29H2,1-4H3,(H,30,33)