ethyl 6-bromanyl-5-[2-[(3,5-dimethylpyrazol-1-yl)amino]-2-oxidanylidene-ethoxy]-2-methyl-1-(phenylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-[2-[(3,5-dimethylpyrazol-1-yl)amino]-2-oxidanylidene-ethoxy]-2-methyl-1-(phenylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-benzyl-6-bromo-5-[2-[(3,5-dimethylpyrazol-1-yl)amino]-2-oxo-ethoxy]-2-methyl-indole-3-carboxylate CAS Name: 6-bromo-5-[2-[(3,5-dimethyl-1-pyrazolyl)amino]-2-oxoethoxy]-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-6-bromo-5-[2-[(3,5-dimethylpyrazol-1-yl)amino]-2-oxoethoxy]-2-methylindole-3-carboxylate Traditional Name: 1-benzyl-6-bromo-5-[2-[(3,5-dimethylpyrazol-1-yl)amino]-2-keto-ethoxy]-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C26H27BrN4O4 MolecularWeight: 539.42098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OCC(=O)NN3C(=CC(=N3)C)C)Br)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OCC(=O)NN3C(=CC(=N3)C)C)Br)CC4=CC=CC=C4)C

InChI

InChI=1S/C26H27BrN4O4/c1-5-34-26(33)25-18(4)30(14-19-9-7-6-8-10-19)22-13-21(27)23(12-20(22)25)35-15-24(32)29-31-17(3)11-16(2)28-31/h6-13H,5,14-15H2,1-4H3,(H,29,32)