2-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-1-(4-prop-2-enylpiperazin-1-yl)ethanone

Systemtic Name: 2-(5-chloranyl-3-methyl-1-benzothiophen-2-yl)-1-(4-prop-2-enylpiperazin-1-yl)ethanone Openeye Name: 1-(4-allylpiperazin-1-yl)-2-(5-chloro-3-methyl-benzothiophen-2-yl)ethanone CAS Name: 2-(5-chloro-3-methyl-1-benzothiophen-2-yl)-1-(4-prop-2-enyl-1-piperazinyl)ethanone IUPAC Name: 2-(5-chloro-3-methyl-1-benzothiophen-2-yl)-1-(4-prop-2-enylpiperazin-1-yl)ethanone Traditional Name: 1-(4-allylpiperazino)-2-(5-chloro-3-methyl-benzothiophen-2-yl)ethanone Formula: C18H21ClN2OS MolecularWeight: 348.89014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)CC(=O)N3CCN(CC3)CC=C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)CC(=O)N3CCN(CC3)CC=C

InChI

InChI=1S/C18H21ClN2OS/c1-3-6-20-7-9-21(10-8-20)18(22)12-17-13(2)15-11-14(19)4-5-16(15)23-17/h3-5,11H,1,6-10,12H2,2H3