4-methyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[2-(m-tolylmethylsulfanyl)ethyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[2-[(3-methylphenyl)methylthio]ethyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[2-[(3-methylbenzyl)thio]ethyl]-3-nitro-benzamide Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S/c1-13-4-3-5-15(10-13)12-24-9-8-19-18(21)16-7-6-14(2)17(11-16)20(22)23/h3-7,10-11H,8-9,12H2,1-2H3,(H,19,21)