1-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-2-(4-nitrophenyl)ethanone

Systemtic Name: 1-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-2-(4-nitrophenyl)ethanone Openeye Name: 1-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-2-(4-nitrophenyl)ethanone CAS Name: 1-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-2-(4-nitrophenyl)ethanone IUPAC Name: 1-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-2-(4-nitrophenyl)ethanone Traditional Name: 1-[4-[(5-chloro-2-thienyl)methyl]piperazino]-2-(4-nitrophenyl)ethanone Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Cl)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Cl)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18ClN3O3S/c18-16-6-5-15(25-16)12-19-7-9-20(10-8-19)17(22)11-13-1-3-14(4-2-13)21(23)24/h1-6H,7-12H2