N-butan-2-yl-3-(cyclopropylcarbonylcarbamothioylamino)benzamide

Systemtic Name: N-butan-2-yl-3-(cyclopropylcarbonylcarbamothioylamino)benzamide Openeye Name: 3-(cyclopropanecarbonylcarbamothioylamino)-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-3-[[[[cyclopropyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butan-2-yl-3-(cyclopropanecarbonylcarbamothioylamino)benzamide Traditional Name: 3-(cyclopropanecarbonylthiocarbamoylamino)-N-sec-butyl-benzamide Formula: C16H21N3O2S MolecularWeight: 319.42184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2CC2

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2CC2

InChI

InChI=1S/C16H21N3O2S/c1-3-10(2)17-15(21)12-5-4-6-13(9-12)18-16(22)19-14(20)11-7-8-11/h4-6,9-11H,3,7-8H2,1-2H3,(H,17,21)(H2,18,19,20,22)