4-(hexanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: 4-(hexanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide Openeye Name: 4-(hexanoylcarbamothioylamino)-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 4-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]-N-(2-oxolanylmethyl)benzamide IUPAC Name: 4-(hexanoylcarbamothioylamino)-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 4-(caproylthiocarbamoylamino)-N-(tetrahydrofurfuryl)benzamide Formula: C19H27N3O3S MolecularWeight: 377.50098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCC2CCCO2

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCC2CCCO2

InChI

InChI=1S/C19H27N3O3S/c1-2-3-4-7-17(23)22-19(26)21-15-10-8-14(9-11-15)18(24)20-13-16-6-5-12-25-16/h8-11,16H,2-7,12-13H2,1H3,(H,20,24)(H2,21,22,23,26)