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

Systemtic Name: 2-[(2-nitrophenyl)carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[(2-nitrobenzoyl)carbamothioylamino]benzamide CAS Name: 2-[[[[(2-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[(2-nitrobenzoyl)carbamothioylamino]benzamide Traditional Name: N-benzyl-2-[(2-nitrobenzoyl)thiocarbamoylamino]benzamide Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4S/c27-20(23-14-15-8-2-1-3-9-15)16-10-4-6-12-18(16)24-22(31)25-21(28)17-11-5-7-13-19(17)26(29)30/h1-13H,14H2,(H,23,27)(H2,24,25,28,31)