N-[1-[[3-(1H-indol-3-yl)-1-[methyl(phenylsulfonyl)amino]-1-oxidanylidene-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-[methyl(phenylsulfonyl)amino]-1-oxidanylidene-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-[[2-[benzenesulfonyl(methyl)amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]amino]-1-[(4-isoxazol-5-ylphenyl)methyl]-2-oxo-ethyl]-N,3,5-trimethyl-benzamide CAS Name: N-[1-[[1-[benzenesulfonyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-[4-(5-isoxazolyl)phenyl]-1-oxopropan-2-yl]-N,3,5-trimethylbenzamide IUPAC Name: N-[1-[[1-[benzenesulfonyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-[4-(1,2-oxazol-5-yl)phenyl]-1-oxopropan-2-yl]-N,3,5-trimethylbenzamide Traditional Name: N-[2-[[2-[besyl(methyl)amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]amino]-1-(4-isoxazol-5-ylbenzyl)-2-keto-ethyl]-N,3,5-trimethyl-benzamide Formula: C40H39N5O6S MolecularWeight: 717.83256

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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)N(C)S(=O)(=O)C6=CC=CC=C6)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)N(C)S(=O)(=O)C6=CC=CC=C6)C

InChI

InChI=1S/C40H39N5O6S/c1-26-20-27(2)22-30(21-26)39(47)44(3)36(23-28-14-16-29(17-15-28)37-18-19-42-51-37)38(46)43-35(24-31-25-41-34-13-9-8-12-33(31)34)40(48)45(4)52(49,50)32-10-6-5-7-11-32/h5-22,25,35-36,41H,23-24H2,1-4H3,(H,43,46)