2-(octanoylcarbamothioylamino)-N-(3-oxidanylpropyl)benzamide

Systemtic Name: 2-(octanoylcarbamothioylamino)-N-(3-oxidanylpropyl)benzamide Openeye Name: N-(3-hydroxypropyl)-2-(octanoylcarbamothioylamino)benzamide CAS Name: N-(3-hydroxypropyl)-2-[[(1-oxooctylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-hydroxypropyl)-2-(octanoylcarbamothioylamino)benzamide Traditional Name: 2-(caprylylthiocarbamoylamino)-N-(3-hydroxypropyl)benzamide Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O3S/c1-2-3-4-5-6-12-17(24)22-19(26)21-16-11-8-7-10-15(16)18(25)20-13-9-14-23/h7-8,10-11,23H,2-6,9,12-14H2,1H3,(H,20,25)(H2,21,22,24,26)