ethyl 6-bromanyl-1-(4-bromophenyl)-4-(dimethylaminomethyl)-5-oxidanyl-2-(phenylsulfanylmethyl)indole-3-carboxylate hydrochloride

Systemtic Name: ethyl 6-bromanyl-1-(4-bromophenyl)-4-(dimethylaminomethyl)-5-oxidanyl-2-(phenylsulfanylmethyl)indole-3-carboxylate hydrochloride Openeye Name: ethyl 6-bromo-1-(4-bromophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-(phenylsulfanylmethyl)indole-3-carboxylate hydrochloride CAS Name: 6-bromo-1-(4-bromophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-[(phenylthio)methyl]-3-indolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 6-bromo-1-(4-bromophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-(phenylsulfanylmethyl)indole-3-carboxylate hydrochloride Traditional Name: 6-bromo-1-(4-bromophenyl)-4-(dimethylaminomethyl)-5-hydroxy-2-[(phenylthio)methyl]indole-3-carboxylic acid ethyl ester hydrochloride Formula: C27H27Br2ClN2O3S MolecularWeight: 654.84088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC=C(C=C3)Br)CSC4=CC=CC=C4.Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C3=CC=C(C=C3)Br)CSC4=CC=CC=C4.Cl

InChI

InChI=1S/C27H26Br2N2O3S.ClH/c1-4-34-27(33)25-23(16-35-19-8-6-5-7-9-19)31(18-12-10-17(28)11-13-18)22-14-21(29)26(32)20(24(22)25)15-30(2)3;/h5-14,32H,4,15-16H2,1-3H3;1H