(3S)-N-[2-(3-methylphenoxy)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-(3-methylphenoxy)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(3-methylphenoxy)ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[2-(3-methylphenoxy)ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(3-methylphenoxy)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[2-(3-methylphenoxy)ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C19H24N2O4S2 MolecularWeight: 408.53486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H24N2O4S2/c1-15-5-2-7-17(13-15)25-11-9-20-19(22)16-6-3-10-21(14-16)27(23,24)18-8-4-12-26-18/h2,4-5,7-8,12-13,16H,3,6,9-11,14H2,1H3,(H,20,22)/t16-/m0/s1