N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-3,5-dinitro-benzamide Openeye Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-3,5-dinitro-benzamide CAS Name: N-[2-[(2-chlorophenyl)methylthio]ethyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-3,5-dinitrobenzamide Traditional Name: N-[2-[(2-chlorobenzyl)thio]ethyl]-3,5-dinitro-benzamide Formula: C16H14ClN3O5S MolecularWeight: 395.81746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O5S/c17-15-4-2-1-3-11(15)10-26-6-5-18-16(21)12-7-13(19(22)23)9-14(8-12)20(24)25/h1-4,7-9H,5-6,10H2,(H,18,21)