2-(5-chloranyl-1-benzothiophen-3-yl)-1-[2-[(4-methylpiperazin-1-yl)methyl]piperidin-1-yl]ethanone

Systemtic Name: 2-(5-chloranyl-1-benzothiophen-3-yl)-1-[2-[(4-methylpiperazin-1-yl)methyl]piperidin-1-yl]ethanone Openeye Name: 2-(5-chlorobenzothiophen-3-yl)-1-[2-[(4-methylpiperazin-1-yl)methyl]-1-piperidyl]ethanone CAS Name: 2-(5-chloro-1-benzothiophen-3-yl)-1-[2-[(4-methyl-1-piperazinyl)methyl]-1-piperidinyl]ethanone IUPAC Name: 2-(5-chloro-1-benzothiophen-3-yl)-1-[2-[(4-methylpiperazin-1-yl)methyl]piperidin-1-yl]ethanone Traditional Name: 2-(5-chlorobenzothiophen-3-yl)-1-[2-[(4-methylpiperazino)methyl]piperidino]ethanone Formula: C21H28ClN3OS MolecularWeight: 405.98452

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2CCCCN2C(=O)CC3=CSC4=C3C=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)CC2CCCCN2C(=O)CC3=CSC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C21H28ClN3OS/c1-23-8-10-24(11-9-23)14-18-4-2-3-7-25(18)21(26)12-16-15-27-20-6-5-17(22)13-19(16)20/h5-6,13,15,18H,2-4,7-12,14H2,1H3