N-[2-(4-chlorophenyl)sulfanylethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-methyl-3-nitro-benzamide Formula: C16H15ClN2O3S MolecularWeight: 350.8199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H15ClN2O3S/c1-11-14(3-2-4-15(11)19(21)22)16(20)18-9-10-23-13-7-5-12(17)6-8-13/h2-8H,9-10H2,1H3,(H,18,20)