N-cyclohexyl-4-[(4-nitrophenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-cyclohexyl-4-[(4-nitrophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-cyclohexyl-4-[(4-nitrobenzoyl)carbamothioylamino]benzamide CAS Name: N-cyclohexyl-4-[[[[(4-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-4-[(4-nitrobenzoyl)carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-4-[(4-nitrobenzoyl)thiocarbamoylamino]benzamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4S/c26-19(22-16-4-2-1-3-5-16)14-6-10-17(11-7-14)23-21(30)24-20(27)15-8-12-18(13-9-15)25(28)29/h6-13,16H,1-5H2,(H,22,26)(H2,23,24,27,30)