4-(2,2-dimethylpropanoylcarbamothioylamino)-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 4-(2,2-dimethylpropanoylcarbamothioylamino)-N-(furan-2-ylmethyl)benzamide Openeye Name: 4-(2,2-dimethylpropanoylcarbamothioylamino)-N-(2-furylmethyl)benzamide CAS Name: 4-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-N-(2-furanylmethyl)benzamide IUPAC Name: 4-(2,2-dimethylpropanoylcarbamothioylamino)-N-(furan-2-ylmethyl)benzamide Traditional Name: N-(2-furfuryl)-4-(pivaloylthiocarbamoylamino)benzamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCC2=CC=CO2

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCC2=CC=CO2

InChI

InChI=1S/C18H21N3O3S/c1-18(2,3)16(23)21-17(25)20-13-8-6-12(7-9-13)15(22)19-11-14-5-4-10-24-14/h4-10H,11H2,1-3H3,(H,19,22)(H2,20,21,23,25)