ethyl 4-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-isopropoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-propan-2-yloxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-isopropoxybenzoyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C20H22N2O4S/c1-4-25-19(24)15-5-9-16(10-6-15)21-20(27)22-18(23)14-7-11-17(12-8-14)26-13(2)3/h5-13H,4H2,1-3H3,(H2,21,22,23,27)