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

Systemtic Name: 3-methyl-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-2-nitro-benzamide Openeye Name: 3-methyl-N-[4-(4-methylsulfanylphenyl)thiazol-2-yl]-2-nitro-benzamide CAS Name: 3-methyl-N-[4-[4-(methylthio)phenyl]-2-thiazolyl]-2-nitrobenzamide IUPAC Name: 3-methyl-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-2-nitrobenzamide Traditional Name: 3-methyl-N-[4-[4-(methylthio)phenyl]thiazol-2-yl]-2-nitro-benzamide Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)SC

InChI

InChI=1S/C18H15N3O3S2/c1-11-4-3-5-14(16(11)21(23)24)17(22)20-18-19-15(10-26-18)12-6-8-13(25-2)9-7-12/h3-10H,1-2H3,(H,19,20,22)