3-(hexanoylcarbamothioylamino)-N,N-dimethyl-benzamide

Systemtic Name: 3-(hexanoylcarbamothioylamino)-N,N-dimethyl-benzamide Openeye Name: 3-(hexanoylcarbamothioylamino)-N,N-dimethyl-benzamide CAS Name: N,N-dimethyl-3-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: 3-(hexanoylcarbamothioylamino)-N,N-dimethylbenzamide Traditional Name: 3-(caproylthiocarbamoylamino)-N,N-dimethyl-benzamide Formula: C16H23N3O2S MolecularWeight: 321.43772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2S/c1-4-5-6-10-14(20)18-16(22)17-13-9-7-8-12(11-13)15(21)19(2)3/h7-9,11H,4-6,10H2,1-3H3,(H2,17,18,20,22)