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

Systemtic Name: 3-methyl-N-[4-[[[3-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]carbamoyl]phenyl]benzamide Openeye Name: N-[4-[[(3-isobutoxybenzoyl)carbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-[[[[[[3-(2-methylpropoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 3-methyl-N-[4-[[[3-(2-methylpropoxy)benzoyl]carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: N-[4-[[(3-isobutoxybenzoyl)thiocarbamoylamino]carbamoyl]phenyl]-3-methyl-benzamide Formula: C27H28N4O4S MolecularWeight: 504.60062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C27H28N4O4S/c1-17(2)16-35-23-9-5-8-21(15-23)25(33)29-27(36)31-30-26(34)19-10-12-22(13-11-19)28-24(32)20-7-4-6-18(3)14-20/h4-15,17H,16H2,1-3H3,(H,28,32)(H,30,34)(H2,29,31,33,36)