butyl 4-[(3,4,5-triethoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: butyl 4-[(3,4,5-triethoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: butyl 4-[(3,4,5-triethoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(3,4,5-triethoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(3,4,5-triethoxybenzoyl)thiocarbamoylamino]benzoic acid butyl ester Formula: C25H32N2O6S MolecularWeight: 488.59638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC

InChI

InChI=1S/C25H32N2O6S/c1-5-9-14-33-24(29)17-10-12-19(13-11-17)26-25(34)27-23(28)18-15-20(30-6-2)22(32-8-4)21(16-18)31-7-3/h10-13,15-16H,5-9,14H2,1-4H3,(H2,26,27,28,34)