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

Systemtic Name: N-(4-acetamidophenyl)-1-(5-bromanylthiophen-2-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-[(5-bromo-2-thienyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(4-acetamidophenyl)-1-[(5-bromo-2-thiophenyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-(5-bromothiophen-2-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-[(5-bromo-2-thienyl)sulfonyl]isonipecotamide Formula: C18H20BrN3O4S2 MolecularWeight: 486.4031

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C18H20BrN3O4S2/c1-12(23)20-14-2-4-15(5-3-14)21-18(24)13-8-10-22(11-9-13)28(25,26)17-7-6-16(19)27-17/h2-7,13H,8-11H2,1H3,(H,20,23)(H,21,24)