1-(5-bromanylthiophen-2-yl)sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)piperidine-3-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)piperidine-3-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(5-methylisoxazol-3-yl)piperidine-3-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(5-methyl-3-isoxazolyl)-3-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)piperidine-3-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(5-methylisoxazol-3-yl)nipecotamide Formula: C14H16BrN3O4S2 MolecularWeight: 434.32854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C14H16BrN3O4S2/c1-9-7-12(17-22-9)16-14(19)10-3-2-6-18(8-10)24(20,21)13-5-4-11(15)23-13/h4-5,7,10H,2-3,6,8H2,1H3,(H,16,17,19)