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

Systemtic Name: N-cyclohexyl-2-[(2-nitrophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-2-[(2-nitrobenzoyl)carbamothioylamino]benzamide CAS Name: N-cyclohexyl-2-[[[[(2-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[(2-nitrobenzoyl)carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-2-[(2-nitrobenzoyl)thiocarbamoylamino]benzamide Formula: C21H22N4O4S MolecularWeight: 426.48878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O4S/c26-19(22-14-8-2-1-3-9-14)15-10-4-6-12-17(15)23-21(30)24-20(27)16-11-5-7-13-18(16)25(28)29/h4-7,10-14H,1-3,8-9H2,(H,22,26)(H2,23,24,27,30)