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

Systemtic Name: 3-methyl-N-[4-[[(3-nitrophenyl)carbonylcarbamothioylamino]carbamoyl]phenyl]benzamide Openeye Name: 3-methyl-N-[4-[[(3-nitrobenzoyl)carbamothioylamino]carbamoyl]phenyl]benzamide CAS Name: 3-methyl-N-[4-[[[[[(3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 3-methyl-N-[4-[[(3-nitrobenzoyl)carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: 3-methyl-N-[4-[[(3-nitrobenzoyl)thiocarbamoylamino]carbamoyl]phenyl]benzamide Formula: C23H19N5O5S MolecularWeight: 477.49246

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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)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O5S/c1-14-4-2-5-16(12-14)20(29)24-18-10-8-15(9-11-18)22(31)26-27-23(34)25-21(30)17-6-3-7-19(13-17)28(32)33/h2-13H,1H3,(H,24,29)(H,26,31)(H2,25,27,30,34)