(3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-prop-2-enyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-prop-2-enyl-piperidine-3-carboxamide Openeye Name: (3S)-N-allyl-1-[(5-bromo-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: (3S)-1-[(5-bromo-2-thiophenyl)sulfonyl]-N-prop-2-enyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-(5-bromothiophen-2-yl)sulfonyl-N-prop-2-enylpiperidine-3-carboxamide Traditional Name: (3S)-N-allyl-1-[(5-bromo-2-thienyl)sulfonyl]nipecotamide Formula: C13H17BrN2O3S2 MolecularWeight: 393.31968

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

C=CCNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C13H17BrN2O3S2/c1-2-7-15-13(17)10-4-3-8-16(9-10)21(18,19)12-6-5-11(14)20-12/h2,5-6,10H,1,3-4,7-9H2,(H,15,17)/t10-/m0/s1