N-methyl-1-[3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanoyl]piperidine-4-carboxamide

Systemtic Name: N-methyl-1-[3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanoyl]piperidine-4-carboxamide Openeye Name: N-methyl-1-[3-[N-(p-tolylsulfonyl)anilino]propanoyl]piperidine-4-carboxamide CAS Name: N-methyl-1-[3-(N-(4-methylphenyl)sulfonylanilino)-1-oxopropyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-1-[3-(N-(4-methylphenyl)sulfonylanilino)propanoyl]piperidine-4-carboxamide Traditional Name: N-methyl-1-[3-(N-tosylanilino)propanoyl]isonipecotamide Formula: C23H29N3O4S MolecularWeight: 443.55906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCC(CC2)C(=O)NC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCC(CC2)C(=O)NC)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O4S/c1-18-8-10-21(11-9-18)31(29,30)26(20-6-4-3-5-7-20)17-14-22(27)25-15-12-19(13-16-25)23(28)24-2/h3-11,19H,12-17H2,1-2H3,(H,24,28)