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

Systemtic Name: 1-(5-bromanylthiophen-2-yl)sulfonyl-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Openeye Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(1-methyl-3-phenyl-propyl)piperidine-4-carboxamide CAS Name: 1-[(5-bromo-2-thiophenyl)sulfonyl]-N-(4-phenylbutan-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(5-bromothiophen-2-yl)sulfonyl-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Traditional Name: 1-[(5-bromo-2-thienyl)sulfonyl]-N-(1-methyl-3-phenyl-propyl)isonipecotamide Formula: C20H25BrN2O3S2 MolecularWeight: 485.4581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C20H25BrN2O3S2/c1-15(7-8-16-5-3-2-4-6-16)22-20(24)17-11-13-23(14-12-17)28(25,26)19-10-9-18(21)27-19/h2-6,9-10,15,17H,7-8,11-14H2,1H3,(H,22,24)