N-(furan-2-ylmethyl)-4-(3-methylbutanoylcarbamothioylamino)benzamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(3-methylbutanoylcarbamothioylamino)benzamide Openeye Name: N-(2-furylmethyl)-4-(3-methylbutanoylcarbamothioylamino)benzamide CAS Name: N-(2-furanylmethyl)-4-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-4-(3-methylbutanoylcarbamothioylamino)benzamide Traditional Name: N-(2-furfuryl)-4-(isovalerylthiocarbamoylamino)benzamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3S/c1-12(2)10-16(22)21-18(25)20-14-7-5-13(6-8-14)17(23)19-11-15-4-3-9-24-15/h3-9,12H,10-11H2,1-2H3,(H,19,23)(H2,20,21,22,25)