butyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate

Systemtic Name: butyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate Openeye Name: butyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate CAS Name: 4-[[[(3,3-dimethyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-(3,3-dimethylbutanoylcarbamothioylamino)benzoate Traditional Name: 4-(3,3-dimethylbutanoylthiocarbamoylamino)benzoic acid butyl ester Formula: C18H26N2O3S MolecularWeight: 350.47564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O3S/c1-5-6-11-23-16(22)13-7-9-14(10-8-13)19-17(24)20-15(21)12-18(2,3)4/h7-10H,5-6,11-12H2,1-4H3,(H2,19,20,21,24)