N-butyl-3-[[4-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butyl-3-[[4-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-butyl-3-[(4-isobutoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-butyl-3-[[[[[4-(2-methylpropoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butyl-3-[[4-(2-methylpropoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-butyl-3-[(4-isobutoxybenzoyl)thiocarbamoylamino]benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCC(C)C

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCC(C)C

InChI

InChI=1S/C23H29N3O3S/c1-4-5-13-24-21(27)18-7-6-8-19(14-18)25-23(30)26-22(28)17-9-11-20(12-10-17)29-15-16(2)3/h6-12,14,16H,4-5,13,15H2,1-3H3,(H,24,27)(H2,25,26,28,30)