2-[4-[(2-chloranyl-4,5-dimethoxy-phenyl)methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanol

Systemtic Name: 2-[4-[(2-chloranyl-4,5-dimethoxy-phenyl)methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanol Openeye Name: 2-[4-[(2-chloro-4,5-dimethoxy-phenyl)methyl]-1-(2-thienylmethyl)piperazin-2-yl]ethanol CAS Name: 2-[4-[(2-chloro-4,5-dimethoxyphenyl)methyl]-1-(thiophen-2-ylmethyl)-2-piperazinyl]ethanol IUPAC Name: 2-[4-[(2-chloro-4,5-dimethoxyphenyl)methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanol Traditional Name: 2-[4-(2-chloro-4,5-dimethoxy-benzyl)-1-(2-thenyl)piperazin-2-yl]ethanol Formula: C20H27ClN2O3S MolecularWeight: 410.95798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN2CCN(C(C2)CCO)CC3=CC=CS3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN2CCN(C(C2)CCO)CC3=CC=CS3)Cl)OC

InChI

InChI=1S/C20H27ClN2O3S/c1-25-19-10-15(18(21)11-20(19)26-2)12-22-6-7-23(16(13-22)5-8-24)14-17-4-3-9-27-17/h3-4,9-11,16,24H,5-8,12-14H2,1-2H3