N-[3-[[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]amino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]amino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]amino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]amino]-3-keto-propyl]adamantane-1-carboxamide Formula: C26H39N3O2 MolecularWeight: 425.60676

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3)N(C)C

InChI

InChI=1S/C26H39N3O2/c1-4-18-5-7-22(8-6-18)23(29(2)3)17-28-24(30)9-10-27-25(31)26-14-19-11-20(15-26)13-21(12-19)16-26/h5-8,19-21,23H,4,9-17H2,1-3H3,(H,27,31)(H,28,30)