ethyl 6-bromanyl-2-[(3-chlorophenyl)sulfinylmethyl]-1-methyl-4-(morpholin-4-ylmethyl)-5-oxidanyl-indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-[(3-chlorophenyl)sulfinylmethyl]-1-methyl-4-(morpholin-4-ylmethyl)-5-oxidanyl-indole-3-carboxylate Openeye Name: ethyl 6-bromo-2-[(3-chlorophenyl)sulfinylmethyl]-5-hydroxy-1-methyl-4-(morpholinomethyl)indole-3-carboxylate CAS Name: 6-bromo-2-[(3-chlorophenyl)sulfinylmethyl]-5-hydroxy-1-methyl-4-(4-morpholinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-[(3-chlorophenyl)sulfinylmethyl]-5-hydroxy-1-methyl-4-(morpholin-4-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-2-[(3-chlorophenyl)sulfinylmethyl]-5-hydroxy-1-methyl-4-(morpholinomethyl)indole-3-carboxylic acid ethyl ester Formula: C24H26BrClN2O5S MolecularWeight: 569.89564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCOCC3)O)Br)C)CS(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCOCC3)O)Br)C)CS(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H26BrClN2O5S/c1-3-33-24(30)22-20(14-34(31)16-6-4-5-15(26)11-16)27(2)19-12-18(25)23(29)17(21(19)22)13-28-7-9-32-10-8-28/h4-6,11-12,29H,3,7-10,13-14H2,1-2H3