N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]cyclohexanecarboxamide

Systemtic Name: N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]cyclohexanecarboxamide Openeye Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-N-sec-butyl-cyclohexanecarboxamide CAS Name: N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]cyclohexanecarboxamide IUPAC Name: N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]cyclohexanecarboxamide Traditional Name: N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]-N-sec-butyl-cyclohexanecarboxamide Formula: C28H40N2O4S MolecularWeight: 500.6932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2)C(=O)C3CCCCC3

Isomeric SMILES

CCC(C)N(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2)C(=O)C3CCCCC3

InChI

InChI=1S/C28H40N2O4S/c1-5-21(2)30(28(32)23-10-7-6-8-11-23)20-27(31)29(19-24-12-9-17-35-24)16-15-22-13-14-25(33-3)26(18-22)34-4/h9,12-14,17-18,21,23H,5-8,10-11,15-16,19-20H2,1-4H3