2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-[[3-(2-methylpiperidin-1-yl)propylamino]methyl]phenol

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-[[3-(2-methylpiperidin-1-yl)propylamino]methyl]phenol Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-[[3-(2-methyl-1-piperidyl)propylamino]methyl]phenol CAS Name: 2-[(5-bromo-2-methoxyphenyl)methylthio]-3-[[3-(2-methyl-1-piperidinyl)propylamino]methyl]phenol IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-[[3-(2-methylpiperidin-1-yl)propylamino]methyl]phenol Traditional Name: 2-[(5-bromo-2-methoxy-benzyl)thio]-3-[[3-(2-methylpiperidino)propylamino]methyl]phenol Formula: C24H33BrN2O2S MolecularWeight: 493.50002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNCC2=C(C(=CC=C2)O)SCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1CCCCN1CCCNCC2=C(C(=CC=C2)O)SCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C24H33BrN2O2S/c1-18-7-3-4-13-27(18)14-6-12-26-16-19-8-5-9-22(28)24(19)30-17-20-15-21(25)10-11-23(20)29-2/h5,8-11,15,18,26,28H,3-4,6-7,12-14,16-17H2,1-2H3