(2R)-3-(1H-indol-3-yl)-2-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]propanoic acid

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]propanoic acid Openeye Name: (2R)-3-(1H-indol-3-yl)-2-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]propanoic acid CAS Name: (2R)-3-(1H-indol-3-yl)-2-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]propanoic acid IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]propanoic acid Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[(2-keto-6-methyl-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]propionic acid Formula: C19H18N4O5S MolecularWeight: 414.43502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O)NC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)O)NC(=O)N2

InChI

InChI=1S/C19H18N4O5S/c1-10-6-14-15(22-19(26)21-14)8-17(10)29(27,28)23-16(18(24)25)7-11-9-20-13-5-3-2-4-12(11)13/h2-6,8-9,16,20,23H,7H2,1H3,(H,24,25)(H2,21,22,26)/t16-/m1/s1