2-(3-methylbutanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 2-(3-methylbutanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 2-(3-methylbutanoylcarbamothioylamino)-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 2-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 2-(3-methylbutanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 2-(isovalerylthiocarbamoylamino)-N-(tetrahydrofurfuryl)benzamide Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C(=O)NCC2CCCO2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C(=O)NCC2CCCO2

InChI

InChI=1S/C18H25N3O3S/c1-12(2)10-16(22)21-18(25)20-15-8-4-3-7-14(15)17(23)19-11-13-6-5-9-24-13/h3-4,7-8,12-13H,5-6,9-11H2,1-2H3,(H,19,23)(H2,20,21,22,25)