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

Systemtic Name: 3-(2-chlorophenyl)-N-[[(2-nitrophenyl)carbonylamino]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[(2-nitrobenzoyl)amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[(2-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[(2-nitrobenzoyl)amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[(2-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/c18-13-7-3-1-5-11(13)9-10-15(23)19-17(27)21-20-16(24)12-6-2-4-8-14(12)22(25)26/h1-8H,9-10H2,(H,20,24)(H2,19,21,23,27)