N-[3-[ethyl-(3-methylphenyl)amino]propyl]-1-propylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-[ethyl-(3-methylphenyl)amino]propyl]-1-propylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-1-propylsulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(N-ethyl-3-methylanilino)propyl]-1-propylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(N-ethyl-3-methylanilino)propyl]-1-propylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-1-propylsulfonyl-isonipecotamide Formula: C21H35N3O3S MolecularWeight: 409.5859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)C(=O)NCCCN(CC)C2=CC=CC(=C2)C

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)C(=O)NCCCN(CC)C2=CC=CC(=C2)C

InChI

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