N-[4-[[(4-fluorophenyl)carbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-[[(4-fluorophenyl)carbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide Openeye Name: N-[4-[[(4-fluorophenyl)carbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide CAS Name: N-[4-[[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[[(4-fluorophenyl)carbamothioylamino]carbamoyl]phenyl]-3-methylbenzamide Traditional Name: N-[4-[[(4-fluorophenyl)thiocarbamoylamino]carbamoyl]phenyl]-3-methyl-benzamide Formula: C22H19FN4O2S MolecularWeight: 422.475263

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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)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H19FN4O2S/c1-14-3-2-4-16(13-14)20(28)24-18-9-5-15(6-10-18)21(29)26-27-22(30)25-19-11-7-17(23)8-12-19/h2-13H,1H3,(H,24,28)(H,26,29)(H2,25,27,30)