N-[(2R)-1-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-1-[[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1R)-1-[[2-(2-ethylanilino)-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2R)-1-[[2-(2-ethylanilino)-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-1-[[2-(2-ethylanilino)-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1R)-1-[[2-(2-ethylanilino)-2-keto-ethyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C26H37N3O3 MolecularWeight: 439.59028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)[C@@H](C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C26H37N3O3/c1-4-20-7-5-6-8-21(20)28-22(30)15-27-24(31)23(16(2)3)29-25(32)26-12-17-9-18(13-26)11-19(10-17)14-26/h5-8,16-19,23H,4,9-15H2,1-3H3,(H,27,31)(H,28,30)(H,29,32)/t17?,18?,19?,23-,26?/m1/s1