N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-4-nitro-benzamide

Systemtic Name: N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[4-(4-methylsulfanylphenyl)thiazol-2-yl]-4-nitro-benzamide CAS Name: N-[4-[4-(methylthio)phenyl]-2-thiazolyl]-4-nitrobenzamide IUPAC Name: N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[4-[4-(methylthio)phenyl]thiazol-2-yl]-4-nitro-benzamide Formula: C17H13N3O3S2 MolecularWeight: 371.43342

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O3S2/c1-24-14-8-4-11(5-9-14)15-10-25-17(18-15)19-16(21)12-2-6-13(7-3-12)20(22)23/h2-10H,1H3,(H,18,19,21)