butyl 4-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: butyl 4-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: butyl 4-[(2,6-dimethoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(2,6-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2,6-dimethoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(2,6-dimethoxybenzoyl)thiocarbamoylamino]benzoic acid butyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C21H24N2O5S/c1-4-5-13-28-20(25)14-9-11-15(12-10-14)22-21(29)23-19(24)18-16(26-2)7-6-8-17(18)27-3/h6-12H,4-5,13H2,1-3H3,(H2,22,23,24,29)