N-butyl-3-(hexanoylcarbamothioylamino)benzamide

Systemtic Name: N-butyl-3-(hexanoylcarbamothioylamino)benzamide Openeye Name: N-butyl-3-(hexanoylcarbamothioylamino)benzamide CAS Name: N-butyl-3-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butyl-3-(hexanoylcarbamothioylamino)benzamide Traditional Name: N-butyl-3-(caproylthiocarbamoylamino)benzamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2S/c1-3-5-7-11-16(22)21-18(24)20-15-10-8-9-14(13-15)17(23)19-12-6-4-2/h8-10,13H,3-7,11-12H2,1-2H3,(H,19,23)(H2,20,21,22,24)