N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(4-methoxy-3-morpholinosulfonyl-phenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(4-methoxy-3-morpholinosulfonyl-phenyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C21H27N3O7S3 MolecularWeight: 529.64998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H27N3O7S3/c1-30-18-7-6-17(14-19(18)33(26,27)23-9-11-31-12-10-23)22-21(25)16-4-2-8-24(15-16)34(28,29)20-5-3-13-32-20/h3,5-7,13-14,16H,2,4,8-12,15H2,1H3,(H,22,25)