4-methylsulfanyl-3-nitro-N-(2,4,6-trimethylphenyl)benzamide

Systemtic Name: 4-methylsulfanyl-3-nitro-N-(2,4,6-trimethylphenyl)benzamide Openeye Name: 4-methylsulfanyl-3-nitro-N-(2,4,6-trimethylphenyl)benzamide CAS Name: 4-(methylthio)-3-nitro-N-(2,4,6-trimethylphenyl)benzamide IUPAC Name: 4-methylsulfanyl-3-nitro-N-(2,4,6-trimethylphenyl)benzamide Traditional Name: N-mesityl-4-(methylthio)-3-nitro-benzamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3S/c1-10-7-11(2)16(12(3)8-10)18-17(20)13-5-6-15(23-4)14(9-13)19(21)22/h5-9H,1-4H3,(H,18,20)