N-(2-ethylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(2-ethylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-(ethylthio)phenyl]-1-(3-phenylpropylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(2-ethylsulfanylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Traditional Name: N-[2-(ethylthio)phenyl]-1-(3-phenylpropylsulfonyl)nipecotamide Formula: C23H30N2O3S2 MolecularWeight: 446.6259

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C23H30N2O3S2/c1-2-29-22-15-7-6-14-21(22)24-23(26)20-13-8-16-25(18-20)30(27,28)17-9-12-19-10-4-3-5-11-19/h3-7,10-11,14-15,20H,2,8-9,12-13,16-18H2,1H3,(H,24,26)