N-[(2-chlorophenyl)methyl]-4-nitro-benzenecarbothioamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-4-nitro-benzenecarbothioamide Openeye Name: N-[(2-chlorophenyl)methyl]-4-nitro-benzenecarbothioamide CAS Name: N-[(2-chlorophenyl)methyl]-4-nitrobenzenecarbothioamide IUPAC Name: N-[(2-chlorophenyl)methyl]-4-nitrobenzenecarbothioamide Traditional Name: N-(2-chlorobenzyl)-4-nitro-thiobenzamide Formula: C14H11ClN2O2S MolecularWeight: 306.76734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN2O2S/c15-13-4-2-1-3-11(13)9-16-14(20)10-5-7-12(8-6-10)17(18)19/h1-8H,9H2,(H,16,20)