[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone

Systemtic Name: [4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone Openeye Name: [4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-(3-methyl-4-nitro-phenyl)methanone CAS Name: [4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-(3-methyl-4-nitrophenyl)methanone IUPAC Name: [4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-(3-methyl-4-nitrophenyl)methanone Traditional Name: [4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-(3-methyl-4-nitro-phenyl)methanone Formula: C16H16ClN3O5S2 MolecularWeight: 429.89834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H16ClN3O5S2/c1-11-10-12(2-3-13(11)20(22)23)16(21)18-6-8-19(9-7-18)27(24,25)15-5-4-14(17)26-15/h2-5,10H,6-9H2,1H3