4-methylsulfanyl-3-nitro-N-(phenylmethyl)benzamide

Systemtic Name: 4-methylsulfanyl-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-methylsulfanyl-3-nitro-benzamide CAS Name: 4-(methylthio)-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-benzyl-4-(methylthio)-3-nitro-benzamide Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O3S/c1-21-14-8-7-12(9-13(14)17(19)20)15(18)16-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,16,18)