3-(hexanoylcarbamothioylamino)-N-propyl-benzamide

Systemtic Name: 3-(hexanoylcarbamothioylamino)-N-propyl-benzamide Openeye Name: 3-(hexanoylcarbamothioylamino)-N-propyl-benzamide CAS Name: 3-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 3-(hexanoylcarbamothioylamino)-N-propylbenzamide Traditional Name: 3-(caproylthiocarbamoylamino)-N-propyl-benzamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O2S/c1-3-5-6-10-15(21)20-17(23)19-14-9-7-8-13(12-14)16(22)18-11-4-2/h7-9,12H,3-6,10-11H2,1-2H3,(H,18,22)(H2,19,20,21,23)