N-[3-[ethyl-(3-methylphenyl)amino]propyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-[ethyl-(3-methylphenyl)amino]propyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[3-(N-ethyl-3-methylanilino)propyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[3-(N-ethyl-3-methylanilino)propyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-1-propylsulfonyl-nipecotamide Formula: C21H35N3O3S MolecularWeight: 409.5859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCCCN(CC)C2=CC=CC(=C2)C

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCCCN(CC)C2=CC=CC(=C2)C

InChI

InChI=1S/C21H35N3O3S/c1-4-15-28(26,27)24-14-7-10-19(17-24)21(25)22-12-8-13-23(5-2)20-11-6-9-18(3)16-20/h6,9,11,16,19H,4-5,7-8,10,12-15,17H2,1-3H3,(H,22,25)