N-(3-aminocarbonylphenyl)-1-(4-tert-butylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-aminocarbonylphenyl)-1-(4-tert-butylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-carbamoylphenyl)piperidine-4-carboxamide CAS Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-carbamoylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-carbamoylphenyl)piperidine-4-carboxamide Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-N-(3-carbamoylphenyl)isonipecotamide Formula: C23H29N3O4S MolecularWeight: 443.55906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4S/c1-23(2,3)18-7-9-20(10-8-18)31(29,30)26-13-11-16(12-14-26)22(28)25-19-6-4-5-17(15-19)21(24)27/h4-10,15-16H,11-14H2,1-3H3,(H2,24,27)(H,25,28)