N-[2-[[(4-ethylphenyl)-thiophen-2-yl-methyl]amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[[(4-ethylphenyl)-thiophen-2-yl-methyl]amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[[(4-ethylphenyl)-(2-thienyl)methyl]amino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[[(4-ethylphenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[[(4-ethylphenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[[(4-ethylphenyl)-(2-thienyl)methyl]amino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C26H32N2O2S MolecularWeight: 436.60948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H32N2O2S/c1-2-17-5-7-21(8-6-17)24(22-4-3-9-31-22)28-23(29)16-27-25(30)26-13-18-10-19(14-26)12-20(11-18)15-26/h3-9,18-20,24H,2,10-16H2,1H3,(H,27,30)(H,28,29)