N-[[(1-ethyl-2-methyl-benzimidazol-5-yl)carbonylamino]carbamothioyl]-4-methoxy-benzamide

Systemtic Name: N-[[(1-ethyl-2-methyl-benzimidazol-5-yl)carbonylamino]carbamothioyl]-4-methoxy-benzamide Openeye Name: N-[[(1-ethyl-2-methyl-benzimidazole-5-carbonyl)amino]carbamothioyl]-4-methoxy-benzamide CAS Name: N-[[[(1-ethyl-2-methyl-5-benzimidazolyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: N-[[(1-ethyl-2-methylbenzimidazole-5-carbonyl)amino]carbamothioyl]-4-methoxybenzamide Traditional Name: N-[[(1-ethyl-2-methyl-benzimidazole-5-carbonyl)amino]thiocarbamoyl]-4-methoxy-benzamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=S)NC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=S)NC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C20H21N5O3S/c1-4-25-12(2)21-16-11-14(7-10-17(16)25)19(27)23-24-20(29)22-18(26)13-5-8-15(28-3)9-6-13/h5-11H,4H2,1-3H3,(H,23,27)(H2,22,24,26,29)