N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-1-(3-phenylpropylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Traditional Name: N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)-1-(3-phenylpropylsulfonyl)nipecotamide Formula: C26H35N3O6S2 MolecularWeight: 549.7026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3CCCN(C3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3CCCN(C3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H35N3O6S2/c1-35-25-14-13-23(37(33,34)28-15-5-6-16-28)19-24(25)27-26(30)22-12-7-17-29(20-22)36(31,32)18-8-11-21-9-3-2-4-10-21/h2-4,9-10,13-14,19,22H,5-8,11-12,15-18,20H2,1H3,(H,27,30)