[2-oxidanylidene-2-[(2-phenyl-5-propyl-pyrazol-3-yl)amino]ethyl] 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-phenyl-5-propyl-pyrazol-3-yl)amino]ethyl] 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: [2-oxo-2-[(2-phenyl-5-propyl-pyrazol-3-yl)amino]ethyl] 2-methyl-1-methylsulfonyl-indoline-5-carboxylate CAS Name: 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid [2-oxo-2-[(2-phenyl-5-propyl-3-pyrazolyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(2-phenyl-5-propylpyrazol-3-yl)amino]ethyl] 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: 1-mesyl-2-methyl-indoline-5-carboxylic acid [2-keto-2-[(2-phenyl-5-propyl-pyrazol-3-yl)amino]ethyl] ester Formula: C25H28N4O5S MolecularWeight: 496.57862

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)NC(=O)COC(=O)C2=CC3=C(C=C2)N(C(C3)C)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NN(C(=C1)NC(=O)COC(=O)C2=CC3=C(C=C2)N(C(C3)C)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O5S/c1-4-8-20-15-23(28(27-20)21-9-6-5-7-10-21)26-24(30)16-34-25(31)18-11-12-22-19(14-18)13-17(2)29(22)35(3,32)33/h5-7,9-12,14-15,17H,4,8,13,16H2,1-3H3,(H,26,30)