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

Systemtic Name: N-cyclohexyl-2-[(3-nitrophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-2-[(3-nitrobenzoyl)carbamothioylamino]benzamide CAS Name: N-cyclohexyl-2-[[[[(3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[(3-nitrobenzoyl)carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-2-[(3-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(14-7-6-10-16(13-14)25(28)29)24-21(30)23-18-12-5-4-11-17(18)20(27)22-15-8-2-1-3-9-15/h4-7,10-13,15H,1-3,8-9H2,(H,22,27)(H2,23,24,26,30)