ethyl 4-[(4-propan-2-yloxycarbonylphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-propan-2-yloxycarbonylphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-isopropoxycarbonylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[[4-[oxo(propan-2-yloxy)methyl]anilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-propan-2-yloxycarbonylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-isopropoxycarbonylphenyl)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)NC2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)OC(C)C

InChI

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