N-[2,6-di(propan-2-yl)phenyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(2,6-diisopropylphenyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(2,6-diisopropylphenyl)-4-(methylthio)-3-nitro-benzamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3S/c1-12(2)15-7-6-8-16(13(3)4)19(15)21-20(23)14-9-10-18(26-5)17(11-14)22(24)25/h6-13H,1-5H3,(H,21,23)