N-[3-(dimethylcarbamoyl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(dimethylcarbamoyl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(dimethylcarbamoyl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-[dimethylamino(oxo)methyl]phenyl]-1-(2,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(dimethylcarbamoyl)phenyl]-1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(dimethylcarbamoyl)phenyl]-1-(2,4-dimethylphenyl)sulfonyl-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)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)N(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)N(C)C)C

InChI

InChI=1S/C23H29N3O4S/c1-16-8-9-21(17(2)14-16)31(29,30)26-12-10-18(11-13-26)22(27)24-20-7-5-6-19(15-20)23(28)25(3)4/h5-9,14-15,18H,10-13H2,1-4H3,(H,24,27)