[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 3-(2-methylindolin-1-yl)sulfonylbenzoate CAS Name: 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoate Traditional Name: 3-(2-methylindolin-1-yl)sulfonylbenzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C22H25N3O6S MolecularWeight: 459.5154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C22H25N3O6S/c1-13(2)19(20(26)24-22(23)28)31-21(27)16-8-6-9-17(12-16)32(29,30)25-14(3)11-15-7-4-5-10-18(15)25/h4-10,12-14,19H,11H2,1-3H3,(H3,23,24,26,28)