1-(5-chloranylthiophen-2-yl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-(5-chloro-2-thienyl)propan-1-one CAS Name: 1-(5-chloro-2-thiophenyl)-3-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-(5-chlorothiophen-2-yl)propan-1-one Traditional Name: 3-(4-benzylpiperazino)-1-(5-chloro-2-thienyl)propan-1-one Formula: C18H21ClN2OS MolecularWeight: 348.89014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)C2=CC=C(S2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCC(=O)C2=CC=C(S2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H21ClN2OS/c19-18-7-6-17(23-18)16(22)8-9-20-10-12-21(13-11-20)14-15-4-2-1-3-5-15/h1-7H,8-14H2