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

Systemtic Name: 3-methyl-N-[4-[[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]carbamoyl]phenyl]benzamide Openeye Name: N-[4-[[(3-isopentyloxybenzoyl)carbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-[[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 3-methyl-N-[4-[[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: N-[4-[[(3-isoamoxybenzoyl)thiocarbamoylamino]carbamoyl]phenyl]-3-methyl-benzamide Formula: C28H30N4O4S MolecularWeight: 518.6272

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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)OCCC(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)OCCC(C)C

InChI

InChI=1S/C28H30N4O4S/c1-18(2)14-15-36-24-9-5-8-22(17-24)26(34)30-28(37)32-31-27(35)20-10-12-23(13-11-20)29-25(33)21-7-4-6-19(3)16-21/h4-13,16-18H,14-15H2,1-3H3,(H,29,33)(H,31,35)(H2,30,32,34,37)