propyl 4-[(3,5-dimethylphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[(3,5-dimethylphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: propyl 4-[(3,5-dimethylbenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(3,5-dimethylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(3,5-dimethylbenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(3,5-dimethylbenzoyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)C)C

InChI

InChI=1S/C20H22N2O3S/c1-4-9-25-19(24)15-5-7-17(8-6-15)21-20(26)22-18(23)16-11-13(2)10-14(3)12-16/h5-8,10-12H,4,9H2,1-3H3,(H2,21,22,23,26)