N-cyclohexyl-N-methyl-2-[(3-nitrophenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-cyclohexyl-N-methyl-2-[(3-nitrophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-N-methyl-2-[(3-nitrobenzoyl)carbamothioylamino]benzamide CAS Name: N-cyclohexyl-N-methyl-2-[[[[(3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-N-methyl-2-[(3-nitrobenzoyl)carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-N-methyl-2-[(3-nitrobenzoyl)thiocarbamoylamino]benzamide Formula: C22H24N4O4S MolecularWeight: 440.51536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4S/c1-25(16-9-3-2-4-10-16)21(28)18-12-5-6-13-19(18)23-22(31)24-20(27)15-8-7-11-17(14-15)26(29)30/h5-8,11-14,16H,2-4,9-10H2,1H3,(H2,23,24,27,31)