N-(2-hydroxyethyl)-2-(octanoylcarbamothioylamino)benzamide

Systemtic Name: N-(2-hydroxyethyl)-2-(octanoylcarbamothioylamino)benzamide Openeye Name: N-(2-hydroxyethyl)-2-(octanoylcarbamothioylamino)benzamide CAS Name: N-(2-hydroxyethyl)-2-[[(1-oxooctylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(2-hydroxyethyl)-2-(octanoylcarbamothioylamino)benzamide Traditional Name: 2-(caprylylthiocarbamoylamino)-N-(2-hydroxyethyl)benzamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NCCO

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NCCO

InChI

InChI=1S/C18H27N3O3S/c1-2-3-4-5-6-11-16(23)21-18(25)20-15-10-8-7-9-14(15)17(24)19-12-13-22/h7-10,22H,2-6,11-13H2,1H3,(H,19,24)(H2,20,21,23,25)