N-[2-(5-bromanylthiophen-2-yl)ethyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(S3)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(S3)Br)C

InChI

InChI=1S/C20H25BrN2O3S2/c1-14-3-5-18(13-15(14)2)28(25,26)23-11-8-16(9-12-23)20(24)22-10-7-17-4-6-19(21)27-17/h3-6,13,16H,7-12H2,1-2H3,(H,22,24)