ethyl 4-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioylamino]benzoate CAS Name: 4-[[[4-(1H-benzimidazol-2-yl)anilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-(1H-benzimidazol-2-yl)phenyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H20N4O2S/c1-2-29-22(28)16-9-13-18(14-10-16)25-23(30)24-17-11-7-15(8-12-17)21-26-19-5-3-4-6-20(19)27-21/h3-14H,2H2,1H3,(H,26,27)(H2,24,25,30)