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

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-[(1-phenylcyclobutyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-[(1-phenylcyclobutyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-[(1-phenylcyclobutyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-[(1-phenylcyclobutyl)methyl]piperidine-4-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-[(1-phenylcyclobutyl)methyl]isonipecotamide Formula: C21H25BrN2O3S2 MolecularWeight: 497.4688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CC(C1)(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)C4=CC=CC=C4

InChI

InChI=1S/C21H25BrN2O3S2/c22-18-7-8-19(28-18)29(26,27)24-13-9-16(10-14-24)20(25)23-15-21(11-4-12-21)17-5-2-1-3-6-17/h1-3,5-8,16H,4,9-15H2,(H,23,25)