N-tert-butyl-3-(octanoylcarbamothioylamino)benzamide

Systemtic Name: N-tert-butyl-3-(octanoylcarbamothioylamino)benzamide Openeye Name: N-tert-butyl-3-(octanoylcarbamothioylamino)benzamide CAS Name: N-tert-butyl-3-[[(1-oxooctylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-3-(octanoylcarbamothioylamino)benzamide Traditional Name: N-tert-butyl-3-(caprylylthiocarbamoylamino)benzamide Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O2S/c1-5-6-7-8-9-13-17(24)22-19(26)21-16-12-10-11-15(14-16)18(25)23-20(2,3)4/h10-12,14H,5-9,13H2,1-4H3,(H,23,25)(H2,21,22,24,26)