N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(4-ethylphenyl)-2-methylpropyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[1-(4-ethylphenyl)-2-methylpropyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(4-ethylphenyl)-2-methyl-propyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-4-18-7-9-19(10-8-18)22(17(2)3)25-23(27)20-11-14-26(15-12-20)30(28,29)21-6-5-13-24-16-21/h5-10,13,16-17,20,22H,4,11-12,14-15H2,1-3H3,(H,25,27)