N-[3-(hexanoylcarbamothioylamino)phenyl]benzamide

Systemtic Name: N-[3-(hexanoylcarbamothioylamino)phenyl]benzamide Openeye Name: N-[3-(hexanoylcarbamothioylamino)phenyl]benzamide CAS Name: N-[3-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: N-[3-(hexanoylcarbamothioylamino)phenyl]benzamide Traditional Name: N-[3-(caproylthiocarbamoylamino)phenyl]benzamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H23N3O2S/c1-2-3-5-13-18(24)23-20(26)22-17-12-8-11-16(14-17)21-19(25)15-9-6-4-7-10-15/h4,6-12,14H,2-3,5,13H2,1H3,(H,21,25)(H2,22,23,24,26)