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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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