2-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-propyl-benzamide

Systemtic Name: 2-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-propyl-benzamide Openeye Name: 2-[(3-isopentyloxybenzoyl)carbamothioylamino]-N-propyl-benzamide CAS Name: 2-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 2-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]-N-propylbenzamide Traditional Name: 2-[(3-isoamoxybenzoyl)thiocarbamoylamino]-N-propyl-benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

InChI

InChI=1S/C23H29N3O3S/c1-4-13-24-22(28)19-10-5-6-11-20(19)25-23(30)26-21(27)17-8-7-9-18(15-17)29-14-12-16(2)3/h5-11,15-16H,4,12-14H2,1-3H3,(H,24,28)(H2,25,26,27,30)