N-(4-aminocarbonylphenyl)-1-(5-bromanylthiophen-2-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-1-(5-bromanylthiophen-2-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-carbamoylphenyl)piperidine-4-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(4-carbamoylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(4-carbamoylphenyl)piperidine-4-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(4-carbamoylphenyl)isonipecotamide Formula: C17H18BrN3O4S2 MolecularWeight: 472.37652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C(=O)N)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H18BrN3O4S2/c18-14-5-6-15(26-14)27(24,25)21-9-7-12(8-10-21)17(23)20-13-3-1-11(2-4-13)16(19)22/h1-6,12H,7-10H2,(H2,19,22)(H,20,23)