N-[3-(3-methylphenoxy)propyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(3-methylphenoxy)propyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(3-methylphenoxy)propyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[3-(3-methylphenoxy)propyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(3-methylphenoxy)propyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(3-methylphenoxy)propyl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)C

InChI

InChI=1S/C21H28N2O4S2/c1-16-6-3-8-19(14-16)27-13-5-11-22-21(24)18-7-4-12-23(15-18)29(25,26)20-10-9-17(2)28-20/h3,6,8-10,14,18H,4-5,7,11-13,15H2,1-2H3,(H,22,24)