[1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate

Systemtic Name: [1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate Openeye Name: (2-indolin-1-yl-1-methyl-2-oxo-ethyl) 2-(benzylamino)thiazole-4-carboxylate CAS Name: 2-[(phenylmethyl)amino]-4-thiazolecarboxylic acid [1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] 2-(benzylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(benzylamino)thiazole-4-carboxylic acid (2-indolin-1-yl-2-keto-1-methyl-ethyl) ester Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)OC(=O)C3=CSC(=N3)NCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C21)OC(=O)C3=CSC(=N3)NCC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S/c1-15(20(26)25-12-11-17-9-5-6-10-19(17)25)28-21(27)18-14-29-22(24-18)23-13-16-7-3-2-4-8-16/h2-10,14-15H,11-13H2,1H3,(H,23,24)