N-[1-[[3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-2-ylsulfonylamino)propan-2-yl]amino]-3-[4-(1,2-oxazol-5-yl)phenyl]-1-oxidanylidene-propan-2-yl]-N,3,5-trimethyl-benzamide

Systemtic Name: N-[1-[[3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-2-ylsulfonylamino)propan-2-yl]amino]-3-[4-(1,2-oxazol-5-yl)phenyl]-1-oxidanylidene-propan-2-yl]-N,3,5-trimethyl-benzamide Openeye Name: N-[2-[[1-(1H-indol-3-ylmethyl)-2-oxo-2-(2-pyridylsulfonylamino)ethyl]amino]-1-[(4-isoxazol-5-ylphenyl)methyl]-2-oxo-ethyl]-N,3,5-trimethyl-benzamide CAS Name: N-[1-[[3-(1H-indol-3-yl)-1-oxo-1-(2-pyridinylsulfonylamino)propan-2-yl]amino]-3-[4-(5-isoxazolyl)phenyl]-1-oxopropan-2-yl]-N,3,5-trimethylbenzamide IUPAC Name: N-[1-[[3-(1H-indol-3-yl)-1-oxo-1-(pyridin-2-ylsulfonylamino)propan-2-yl]amino]-3-[4-(1,2-oxazol-5-yl)phenyl]-1-oxopropan-2-yl]-N,3,5-trimethylbenzamide Traditional Name: N-[2-[[1-(1H-indol-3-ylmethyl)-2-keto-2-(2-pyridylsulfonylamino)ethyl]amino]-1-(4-isoxazol-5-ylbenzyl)-2-keto-ethyl]-N,3,5-trimethyl-benzamide Formula: C38H36N6O6S MolecularWeight: 704.79404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N(C)C(CC2=CC=C(C=C2)C3=CC=NO3)C(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)NS(=O)(=O)C6=CC=CC=N6)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N(C)C(CC2=CC=C(C=C2)C3=CC=NO3)C(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)NS(=O)(=O)C6=CC=CC=N6)C

InChI

InChI=1S/C38H36N6O6S/c1-24-18-25(2)20-28(19-24)38(47)44(3)33(21-26-11-13-27(14-12-26)34-15-17-41-50-34)37(46)42-32(22-29-23-40-31-9-5-4-8-30(29)31)36(45)43-51(48,49)35-10-6-7-16-39-35/h4-20,23,32-33,40H,21-22H2,1-3H3,(H,42,46)(H,43,45)