1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(3-nitropyrazol-1-yl)ethanone

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(3-nitropyrazol-1-yl)ethanone Openeye Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-2-(3-nitropyrazol-1-yl)ethanone CAS Name: 1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-(3-nitro-1-pyrazolyl)ethanone IUPAC Name: 1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-2-(3-nitropyrazol-1-yl)ethanone Traditional Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-2-(3-nitropyrazol-1-yl)ethanone Formula: C13H14ClN5O5S2 MolecularWeight: 419.86376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=CC(=N2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=CC(=N2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C13H14ClN5O5S2/c14-10-1-2-13(25-10)26(23,24)18-7-5-16(6-8-18)12(20)9-17-4-3-11(15-17)19(21)22/h1-4H,5-9H2