ethyl 6-bromanyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-5-methoxy-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-5-methoxy-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-5-methoxy-1-phenyl-indole-3-carboxylate CAS Name: 6-bromo-2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-5-methoxy-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-5-methoxy-1-phenylindole-3-carboxylate Traditional Name: 6-bromo-2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-5-methoxy-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C25H24BrN3O3S MolecularWeight: 526.44536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CSC4=NC(=CC(=N4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CSC4=NC(=CC(=N4)C)C

InChI

InChI=1S/C25H24BrN3O3S/c1-5-32-24(30)23-18-12-22(31-4)19(26)13-20(18)29(17-9-7-6-8-10-17)21(23)14-33-25-27-15(2)11-16(3)28-25/h6-13H,5,14H2,1-4H3