3-(2-chlorophenyl)-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[(3-nitrobenzoyl)amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[(3-nitrobenzoyl)amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]propionamide Formula: C17H15ClN4O4S MolecularWeight: 406.8434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN4O4S/c18-14-7-2-1-4-11(14)8-9-15(23)19-17(27)21-20-16(24)12-5-3-6-13(10-12)22(25)26/h1-7,10H,8-9H2,(H,20,24)(H2,19,21,23,27)