N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[4-(2,4-ditert-amylphenoxy)butyl]-1-(2-thenoyl)isonipecotamide Formula: C31H46N2O3S MolecularWeight: 526.77354

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2CCN(CC2)C(=O)C3=CC=CS3)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2CCN(CC2)C(=O)C3=CC=CS3)C(C)(C)CC

InChI

InChI=1S/C31H46N2O3S/c1-7-30(3,4)24-13-14-26(25(22-24)31(5,6)8-2)36-20-10-9-17-32-28(34)23-15-18-33(19-16-23)29(35)27-12-11-21-37-27/h11-14,21-23H,7-10,15-20H2,1-6H3,(H,32,34)