(3S)-1-[2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-[(5-chloranylthiophen-2-yl)sulfonyl-methyl-amino]ethanoyl]piperidine-3-carboxamide Openeye Name: (3S)-1-[2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetyl]piperidine-3-carboxamide CAS Name: (3S)-1-[2-[(5-chloro-2-thiophenyl)sulfonyl-methylamino]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]acetyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[2-[(5-chloro-2-thienyl)sulfonyl-methyl-amino]acetyl]nipecotamide Formula: C13H18ClN3O4S2 MolecularWeight: 379.88272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCC(C1)C(=O)N)S(=O)(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CN(CC(=O)N1CCC[C@@H](C1)C(=O)N)S(=O)(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C13H18ClN3O4S2/c1-16(23(20,21)12-5-4-10(14)22-12)8-11(18)17-6-2-3-9(7-17)13(15)19/h4-5,9H,2-3,6-8H2,1H3,(H2,15,19)/t9-/m0/s1