N-(2,3-dihydro-1H-inden-5-yl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide Openeye Name: N-indan-5-yl-2-(4-methylsulfanyl-3-nitro-benzoyl)benzamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]benzamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(4-methylsulfanyl-3-nitrobenzoyl)benzamide Traditional Name: N-indan-5-yl-2-[4-(methylthio)-3-nitro-benzoyl]benzamide Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(CCC4)C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)NC3=CC4=C(CCC4)C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H20N2O4S/c1-31-22-12-10-17(14-21(22)26(29)30)23(27)19-7-2-3-8-20(19)24(28)25-18-11-9-15-5-4-6-16(15)13-18/h2-3,7-14H,4-6H2,1H3,(H,25,28)