N-ethyl-3-(octanoylcarbamothioylamino)benzamide

Systemtic Name: N-ethyl-3-(octanoylcarbamothioylamino)benzamide Openeye Name: N-ethyl-3-(octanoylcarbamothioylamino)benzamide CAS Name: N-ethyl-3-[[(1-oxooctylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-ethyl-3-(octanoylcarbamothioylamino)benzamide Traditional Name: 3-(caprylylthiocarbamoylamino)-N-ethyl-benzamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NCC

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NCC

InChI

InChI=1S/C18H27N3O2S/c1-3-5-6-7-8-12-16(22)21-18(24)20-15-11-9-10-14(13-15)17(23)19-4-2/h9-11,13H,3-8,12H2,1-2H3,(H,19,23)(H2,20,21,22,24)