N-(5-chloranyl-2,4-dimethoxy-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C18H21ClN2O5S2 MolecularWeight: 444.95274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)Cl)OC

InChI

InChI=1S/C18H21ClN2O5S2/c1-25-15-10-16(26-2)14(9-13(15)19)20-18(22)12-5-3-7-21(11-12)28(23,24)17-6-4-8-27-17/h4,6,8-10,12H,3,5,7,11H2,1-2H3,(H,20,22)