N-butyl-4-(prop-2-enylcarbamothioylamino)benzamide

Systemtic Name: N-butyl-4-(prop-2-enylcarbamothioylamino)benzamide Openeye Name: 4-(allylcarbamothioylamino)-N-butyl-benzamide CAS Name: N-butyl-4-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butyl-4-(prop-2-enylcarbamothioylamino)benzamide Traditional Name: 4-(allylthiocarbamoylamino)-N-butyl-benzamide Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NCC=C

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NCC=C

InChI

InChI=1S/C15H21N3OS/c1-3-5-11-16-14(19)12-6-8-13(9-7-12)18-15(20)17-10-4-2/h4,6-9H,2-3,5,10-11H2,1H3,(H,16,19)(H2,17,18,20)