N1'-[(2S,3R)-4-[(4-methoxyphenyl)sulfonyl-pentyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]cyclopropane-1,1-dicarboxamide

Systemtic Name: N1'-[(2S,3R)-4-[(4-methoxyphenyl)sulfonyl-pentyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]cyclopropane-1,1-dicarboxamide Openeye Name: N1'-[(1S,2R)-1-benzyl-2-hydroxy-3-[(4-methoxyphenyl)sulfonyl-pentyl-amino]propyl]cyclopropane-1,1-dicarboxamide CAS Name: N1'-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-pentylamino]-1-phenylbutan-2-yl]cyclopropane-1,1-dicarboxamide IUPAC Name: 1-N'-[(2S,3R)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-pentylamino]-1-phenylbutan-2-yl]cyclopropane-1,1-dicarboxamide Traditional Name: N'-[(1S,2R)-3-[amyl-(4-methoxyphenyl)sulfonyl-amino]-1-benzyl-2-hydroxy-propyl]cyclopropane-1,1-dicarboxamide Formula: C27H37N3O6S MolecularWeight: 531.66418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(C(CC1=CC=CC=C1)NC(=O)C2(CC2)C(=O)N)O)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCN(C[C@H]([C@H](CC1=CC=CC=C1)NC(=O)C2(CC2)C(=O)N)O)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C27H37N3O6S/c1-3-4-8-17-30(37(34,35)22-13-11-21(36-2)12-14-22)19-24(31)23(18-20-9-6-5-7-10-20)29-26(33)27(15-16-27)25(28)32/h5-7,9-14,23-24,31H,3-4,8,15-19H2,1-2H3,(H2,28,32)(H,29,33)/t23-,24+/m0/s1