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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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