N-[1-(4-tert-butylphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-1-(3-phenylpropylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-1-(3-phenylpropylsulfonyl)nipecotamide Formula: C27H38N2O3S MolecularWeight: 470.66722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C27H38N2O3S/c1-21(23-14-16-25(17-15-23)27(2,3)4)28-26(30)24-13-8-18-29(20-24)33(31,32)19-9-12-22-10-6-5-7-11-22/h5-7,10-11,14-17,21,24H,8-9,12-13,18-20H2,1-4H3,(H,28,30)