2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-N-(phenylmethyl)benzamide

Systemtic Name: 2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-(4-methylsulfanyl-3-nitro-benzoyl)benzamide CAS Name: 2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-(4-methylsulfanyl-3-nitrobenzoyl)benzamide Traditional Name: N-benzyl-2-[4-(methylthio)-3-nitro-benzoyl]benzamide Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O4S/c1-29-20-12-11-16(13-19(20)24(27)28)21(25)17-9-5-6-10-18(17)22(26)23-14-15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,23,26)