3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(5-methyl-1-benzothiophen-3-yl)propan-1-one dihydrochloride

Systemtic Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(5-methyl-1-benzothiophen-3-yl)propan-1-one dihydrochloride Openeye Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(5-methylbenzothiophen-3-yl)propan-1-one dihydrochloride CAS Name: 3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-(5-methyl-1-benzothiophen-3-yl)-1-propanone dihydrochloride IUPAC Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(5-methyl-1-benzothiophen-3-yl)propan-1-one dihydrochloride Traditional Name: 3-[4-(2-methoxyphenyl)piperazino]-1-(5-methylbenzothiophen-3-yl)propan-1-one dihydrochloride Formula: C23H28Cl2N2O2S MolecularWeight: 467.45162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC=C2C(=O)CCN3CCN(CC3)C4=CC=CC=C4OC.Cl.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)SC=C2C(=O)CCN3CCN(CC3)C4=CC=CC=C4OC.Cl.Cl

InChI

InChI=1S/C23H26N2O2S.2ClH/c1-17-7-8-23-18(15-17)19(16-28-23)21(26)9-10-24-11-13-25(14-12-24)20-5-3-4-6-22(20)27-2;;/h3-8,15-16H,9-14H2,1-2H3;2*1H