3-(propanoylcarbamothioylamino)-N-propyl-benzamide

Systemtic Name: 3-(propanoylcarbamothioylamino)-N-propyl-benzamide Openeye Name: 3-(propanoylcarbamothioylamino)-N-propyl-benzamide CAS Name: 3-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 3-(propanoylcarbamothioylamino)-N-propylbenzamide Traditional Name: 3-(propionylthiocarbamoylamino)-N-propyl-benzamide Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CC

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)CC

InChI

InChI=1S/C14H19N3O2S/c1-3-8-15-13(19)10-6-5-7-11(9-10)16-14(20)17-12(18)4-2/h5-7,9H,3-4,8H2,1-2H3,(H,15,19)(H2,16,17,18,20)