N-(3-aminocarbonylthiophen-2-yl)-1-(2-chloranyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-aminocarbonylthiophen-2-yl)-1-(2-chloranyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-carbamoyl-2-thienyl)-1-(2-chloro-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-carbamoyl-2-thiophenyl)-1-(2-chloro-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-carbamoylthiophen-2-yl)-1-(2-chloro-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-carbamoyl-2-thienyl)-1-(2-chloro-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C17H17ClN4O6S2 MolecularWeight: 472.92308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CS2)C(=O)N)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CS2)C(=O)N)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H17ClN4O6S2/c18-13-2-1-11(22(25)26)9-14(13)30(27,28)21-6-3-10(4-7-21)16(24)20-17-12(15(19)23)5-8-29-17/h1-2,5,8-10H,3-4,6-7H2,(H2,19,23)(H,20,24)