3-[methylsulfonyl(phenyl)amino]-N-[(2S,3R)-3-oxidanyl-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-5-prop-1-en-2-yl-benzamide; 6-[(Z)-prop-1-enyl]-2,4-bis[(E)-prop-1-enyl]-1,3,5,2,4,6-trioxatriborinane; pyridine

Systemtic Name: 3-[methylsulfonyl(phenyl)amino]-N-[(2S,3R)-3-oxidanyl-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-5-prop-1-en-2-yl-benzamide; 6-[(Z)-prop-1-enyl]-2,4-bis[(E)-prop-1-enyl]-1,3,5,2,4,6-trioxatriborinane; pyridine Openeye Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-3-isopropenyl-5-(N-methylsulfonylanilino)benzamide; 6-[(Z)-prop-1-enyl]-2,4-bis[(E)-prop-1-enyl]-1,3,5,2,4,6-trioxatriborinane; pyridine CAS Name: N-[(2S,3R)-3-hydroxy-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-3-(1-methylethenyl)-5-(N-methylsulfonylanilino)benzamide; 6-[(Z)-prop-1-enyl]-2,4-bis[(E)-prop-1-enyl]-1,3,5,2,4,6-trioxatriborinane; pyridine IUPAC Name: N-[(2S,3R)-3-hydroxy-1-phenyl-4-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-3-(N-methylsulfonylanilino)-5-prop-1-en-2-ylbenzamide; 6-[(Z)-prop-1-enyl]-2,4-bis[(E)-prop-1-enyl]-1,3,5,2,4,6-trioxatriborinane; pyridine Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[[3-(trifluoromethyl)benzyl]amino]propyl]-3-isopropenyl-5-(N-mesylanilino)benzamide; 6-[(Z)-prop-1-enyl]-2,4-bis[(E)-prop-1-enyl]-1,3,5,2,4,6-trioxatriborinane; pyridine Formula: C49H56B3F3N4O7S MolecularWeight: 934.48475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(OB(OB(O1)C=CC)C=CC)C=CC.CC(=C)C1=CC(=CC(=C1)N(C2=CC=CC=C2)S(=O)(=O)C)C(=O)NC(CC3=CC=CC=C3)C(CNCC4=CC(=CC=C4)C(F)(F)F)O.C1=CC=NC=C1

Isomeric SMILES

B1(OB(OB(O1)/C=C/C)/C=C\C)/C=C/C.CC(=C)C1=CC(=CC(=C1)N(S(=O)(=O)C)C2=CC=CC=C2)C(=O)N[C@H]([C@H](O)CNCC3=CC(=CC=C3)C(F)(F)F)CC4=CC=CC=C4.C1=CC=NC=C1

InChI

InChI=1S/C35H36F3N3O4S.C9H15B3O3.C5H5N/c1-24(2)27-19-28(21-31(20-27)41(46(3,44)45)30-15-8-5-9-16-30)34(43)40-32(18-25-11-6-4-7-12-25)33(42)23-39-22-26-13-10-14-29(17-26)35(36,37)38;1-4-7-10-13-11(8-5-2)15-12(14-10)9-6-3;1-2-4-6-5-3-1/h4-17,19-21,32-33,39,42H,1,18,22-23H2,2-3H3,(H,40,43);4-9H,1-3H3;1-5H/b;7-4-,8-5+,9-6+;/t32-,33+;;/m0../s1