N-butan-2-yl-2-[(4-nitrophenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butan-2-yl-2-[(4-nitrophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 2-[(4-nitrobenzoyl)carbamothioylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[[[(4-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[(4-nitrobenzoyl)carbamothioylamino]benzamide Traditional Name: 2-[(4-nitrobenzoyl)thiocarbamoylamino]-N-sec-butyl-benzamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4S/c1-3-12(2)20-18(25)15-6-4-5-7-16(15)21-19(28)22-17(24)13-8-10-14(11-9-13)23(26)27/h4-12H,3H2,1-2H3,(H,20,25)(H2,21,22,24,28)