3-[(4-nitrophenyl)carbonylcarbamothioylamino]-N-propan-2-yl-benzamide

Systemtic Name: 3-[(4-nitrophenyl)carbonylcarbamothioylamino]-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-3-[(4-nitrobenzoyl)carbamothioylamino]benzamide CAS Name: 3-[[[[(4-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 3-[(4-nitrobenzoyl)carbamothioylamino]-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-3-[(4-nitrobenzoyl)thiocarbamoylamino]benzamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O4S/c1-11(2)19-17(24)13-4-3-5-14(10-13)20-18(27)21-16(23)12-6-8-15(9-7-12)22(25)26/h3-11H,1-2H3,(H,19,24)(H2,20,21,23,27)