2-chloranyl-N-[4-(methylcarbamothioylamino)phenyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-(methylcarbamothioylamino)phenyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[4-(methylcarbamothioylamino)phenyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[4-[[methylamino(sulfanylidene)methyl]amino]phenyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[4-(methylcarbamothioylamino)phenyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[4-(methylthiocarbamoylamino)phenyl]-5-nitro-benzamide Formula: C15H13ClN4O3S MolecularWeight: 364.80672

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CNC(=S)NC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13ClN4O3S/c1-17-15(24)19-10-4-2-9(3-5-10)18-14(21)12-8-11(20(22)23)6-7-13(12)16/h2-8H,1H3,(H,18,21)(H2,17,19,24)