ethyl 5-bromanyl-3-(2-phenylsulfanylethanoylamino)-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-(2-phenylsulfanylethanoylamino)-1H-indole-2-carboxylate Openeye Name: ethyl 5-bromo-3-[(2-phenylsulfanylacetyl)amino]-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[1-oxo-2-(phenylthio)ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[(2-phenylsulfanylacetyl)amino]-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-[[2-(phenylthio)acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C19H17BrN2O3S MolecularWeight: 433.31888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C19H17BrN2O3S/c1-2-25-19(24)18-17(14-10-12(20)8-9-15(14)21-18)22-16(23)11-26-13-6-4-3-5-7-13/h3-10,21H,2,11H2,1H3,(H,22,23)