N-methyl-5-(phenylcarbonylcarbamothioylamino)-1-(2-phenylmethoxyethoxymethyl)imidazole-4-carboxamide

Systemtic Name: N-methyl-5-(phenylcarbonylcarbamothioylamino)-1-(2-phenylmethoxyethoxymethyl)imidazole-4-carboxamide Openeye Name: 5-(benzoylcarbamothioylamino)-1-(2-benzyloxyethoxymethyl)-N-methyl-imidazole-4-carboxamide CAS Name: 5-[[benzamido(sulfanylidene)methyl]amino]-N-methyl-1-(2-phenylmethoxyethoxymethyl)-4-imidazolecarboxamide IUPAC Name: 5-(benzoylcarbamothioylamino)-N-methyl-1-(2-phenylmethoxyethoxymethyl)imidazole-4-carboxamide Traditional Name: 1-(2-benzoxyethoxymethyl)-5-(benzoylthiocarbamoylamino)-N-methyl-imidazole-4-carboxamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(N(C=N1)COCCOCC2=CC=CC=C2)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=C(N(C=N1)COCCOCC2=CC=CC=C2)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25N5O4S/c1-24-22(30)19-20(26-23(33)27-21(29)18-10-6-3-7-11-18)28(15-25-19)16-32-13-12-31-14-17-8-4-2-5-9-17/h2-11,15H,12-14,16H2,1H3,(H,24,30)(H2,26,27,29,33)