1-(5-chloranylthiophen-2-yl)-4-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-4-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-(5-chloro-2-thienyl)-4-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(5-chloro-2-thiophenyl)-4-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(5-chlorothiophen-2-yl)-4-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(5-chloro-2-thienyl)-4-[4-(5-nitrothiophene-2-carbonyl)piperazino]butane-1,4-dione Formula: C17H16ClN3O5S2 MolecularWeight: 441.90904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(S2)Cl)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(S2)Cl)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5S2/c18-14-4-2-12(27-14)11(22)1-5-15(23)19-7-9-20(10-8-19)17(24)13-3-6-16(28-13)21(25)26/h2-4,6H,1,5,7-10H2