1-[4-(4-phenethylpiperazin-1-yl)-1-benzothiophen-2-yl]prop-2-en-1-ol hydrochloride

Systemtic Name: 1-[4-(4-phenethylpiperazin-1-yl)-1-benzothiophen-2-yl]prop-2-en-1-ol hydrochloride Openeye Name: 1-[4-(4-phenethylpiperazin-1-yl)benzothiophen-2-yl]prop-2-en-1-ol hydrochloride CAS Name: 1-[4-(4-phenethyl-1-piperazinyl)-1-benzothiophen-2-yl]-2-propen-1-ol hydrochloride IUPAC Name: 1-[4-(4-phenethylpiperazin-1-yl)-1-benzothiophen-2-yl]prop-2-en-1-ol hydrochloride Traditional Name: 1-[4-(4-phenethylpiperazino)benzothiophen-2-yl]prop-2-en-1-ol hydrochloride Formula: C23H27ClN2OS MolecularWeight: 414.99128

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C1=CC2=C(C=CC=C2S1)N3CCN(CC3)CCC4=CC=CC=C4)O.Cl

Isomeric SMILES

C=CC(C1=CC2=C(C=CC=C2S1)N3CCN(CC3)CCC4=CC=CC=C4)O.Cl

InChI

InChI=1S/C23H26N2OS.ClH/c1-2-21(26)23-17-19-20(9-6-10-22(19)27-23)25-15-13-24(14-16-25)12-11-18-7-4-3-5-8-18;/h2-10,17,21,26H,1,11-16H2;1H