ethyl 4-[[2-(phenylmethyl)phenyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[2-(phenylmethyl)phenyl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[(2-benzylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[[2-(phenylmethyl)anilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-benzylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-benzylphenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2CC3=CC=CC=C3

InChI

InChI=1S/C23H22N2O2S/c1-2-27-22(26)18-12-14-20(15-13-18)24-23(28)25-21-11-7-6-10-19(21)16-17-8-4-3-5-9-17/h3-15H,2,16H2,1H3,(H2,24,25,28)