1-(5-bromanylthiophen-2-yl)sulfonyl-N-[(3-fluoranyl-4-methyl-phenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-[(3-fluoranyl-4-methyl-phenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-[(3-fluoro-4-methyl-phenyl)methyl]piperidine-3-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-[(3-fluoro-4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-[(3-fluoro-4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(3-fluoro-4-methyl-benzyl)nipecotamide Formula: C18H20BrFN2O3S2 MolecularWeight: 475.395403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)Br)F

InChI

InChI=1S/C18H20BrFN2O3S2/c1-12-4-5-13(9-15(12)20)10-21-18(23)14-3-2-8-22(11-14)27(24,25)17-7-6-16(19)26-17/h4-7,9,14H,2-3,8,10-11H2,1H3,(H,21,23)