methyl (2R)-3-(1H-indol-3-yl)-2-[[4-(phenylcarbamoylamino)phenyl]sulfonylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[4-(phenylcarbamoylamino)phenyl]sulfonylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[4-(phenylcarbamoylamino)phenyl]sulfonylamino]propanoate CAS Name: (2R)-2-[[4-[[anilino(oxo)methyl]amino]phenyl]sulfonylamino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[4-(phenylcarbamoylamino)phenyl]sulfonylamino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[4-(phenylcarbamoylamino)phenyl]sulfonylamino]propionic acid methyl ester Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O5S/c1-34-24(30)23(15-17-16-26-22-10-6-5-9-21(17)22)29-35(32,33)20-13-11-19(12-14-20)28-25(31)27-18-7-3-2-4-8-18/h2-14,16,23,26,29H,15H2,1H3,(H2,27,28,31)/t23-/m1/s1