N-tert-butyl-3-(prop-2-enylcarbamothioylamino)benzamide

Systemtic Name: N-tert-butyl-3-(prop-2-enylcarbamothioylamino)benzamide Openeye Name: 3-(allylcarbamothioylamino)-N-tert-butyl-benzamide CAS Name: N-tert-butyl-3-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-3-(prop-2-enylcarbamothioylamino)benzamide Traditional Name: 3-(allylthiocarbamoylamino)-N-tert-butyl-benzamide Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3OS/c1-5-9-16-14(20)17-12-8-6-7-11(10-12)13(19)18-15(2,3)4/h5-8,10H,1,9H2,2-4H3,(H,18,19)(H2,16,17,20)