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

Systemtic Name: 2-methyl-N-[4-[[(2-phenethyloxyphenyl)carbonylcarbamothioylamino]carbamoyl]phenyl]benzamide Openeye Name: 2-methyl-N-[4-[[(2-phenethyloxybenzoyl)carbamothioylamino]carbamoyl]phenyl]benzamide CAS Name: 2-methyl-N-[4-[oxo-[[[[oxo-(2-phenethyloxyphenyl)methyl]amino]-sulfanylidenemethyl]hydrazo]methyl]phenyl]benzamide IUPAC Name: 2-methyl-N-[4-[[(2-phenethyloxybenzoyl)carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: 2-methyl-N-[4-[[(2-phenethyloxybenzoyl)thiocarbamoylamino]carbamoyl]phenyl]benzamide Formula: C31H28N4O4S MolecularWeight: 552.64342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=CC=C3OCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=CC=C3OCCC4=CC=CC=C4

InChI

InChI=1S/C31H28N4O4S/c1-21-9-5-6-12-25(21)29(37)32-24-17-15-23(16-18-24)28(36)34-35-31(40)33-30(38)26-13-7-8-14-27(26)39-20-19-22-10-3-2-4-11-22/h2-18H,19-20H2,1H3,(H,32,37)(H,34,36)(H2,33,35,38,40)