N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-N-sec-butyl-adamantane-1-carboxamide CAS Name: N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-butan-2-yl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]-N-sec-butyl-adamantane-1-carboxamide Formula: C32H44N2O4S MolecularWeight: 552.76776

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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)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(C)N(CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C32H44N2O4S/c1-5-22(2)34(31(36)32-17-24-13-25(18-32)15-26(14-24)19-32)21-30(35)33(20-27-7-6-12-39-27)11-10-23-8-9-28(37-3)29(16-23)38-4/h6-9,12,16,22,24-26H,5,10-11,13-15,17-21H2,1-4H3