4-methylsulfanyl-3-nitro-N-(2-propan-2-ylphenyl)benzamide

Systemtic Name: 4-methylsulfanyl-3-nitro-N-(2-propan-2-ylphenyl)benzamide Openeye Name: N-(2-isopropylphenyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: 4-(methylthio)-3-nitro-N-(2-propan-2-ylphenyl)benzamide IUPAC Name: 4-methylsulfanyl-3-nitro-N-(2-propan-2-ylphenyl)benzamide Traditional Name: 4-(methylthio)-3-nitro-N-o-cumenyl-benzamide Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O3S/c1-11(2)13-6-4-5-7-14(13)18-17(20)12-8-9-16(23-3)15(10-12)19(21)22/h4-11H,1-3H3,(H,18,20)