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

Systemtic Name: N-(furan-2-ylmethyl)-3-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]benzamide Openeye Name: N-(2-furylmethyl)-3-[(3-isopentyloxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(2-furanylmethyl)-3-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-3-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(2-furfuryl)-3-[(3-isoamoxybenzoyl)thiocarbamoylamino]benzamide Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C25H27N3O4S/c1-17(2)11-13-32-21-9-4-7-19(15-21)24(30)28-25(33)27-20-8-3-6-18(14-20)23(29)26-16-22-10-5-12-31-22/h3-10,12,14-15,17H,11,13,16H2,1-2H3,(H,26,29)(H2,27,28,30,33)