ethyl 6-bromanyl-1-methyl-2-[(2-methylfuran-3-yl)sulfinylmethyl]-5-oxidanyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-1-methyl-2-[(2-methylfuran-3-yl)sulfinylmethyl]-5-oxidanyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 6-bromo-5-hydroxy-1-methyl-2-[(2-methyl-3-furyl)sulfinylmethyl]-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate CAS Name: 6-bromo-5-hydroxy-1-methyl-2-[(2-methyl-3-furanyl)sulfinylmethyl]-4-(1-pyrrolidinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-hydroxy-1-methyl-2-[(2-methylfuran-3-yl)sulfinylmethyl]-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Traditional Name: 6-bromo-5-hydroxy-1-methyl-2-[(2-methyl-3-furyl)sulfinylmethyl]-4-(pyrrolidinomethyl)indole-3-carboxylic acid ethyl ester Formula: C23H27BrN2O5S MolecularWeight: 523.43988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCCC3)O)Br)C)CS(=O)C4=C(OC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCCC3)O)Br)C)CS(=O)C4=C(OC=C4)C

InChI

InChI=1S/C23H27BrN2O5S/c1-4-30-23(28)21-18(13-32(29)19-7-10-31-14(19)2)25(3)17-11-16(24)22(27)15(20(17)21)12-26-8-5-6-9-26/h7,10-11,27H,4-6,8-9,12-13H2,1-3H3