N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[4-(4-methylsulfanylphenyl)thiazol-2-yl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[4-[4-(methylthio)phenyl]-2-thiazolyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[4-[4-(methylthio)phenyl]thiazol-2-yl]-2-(2-nitrophenoxy)acetamide Formula: C18H15N3O4S2 MolecularWeight: 401.4594

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O4S2/c1-26-13-8-6-12(7-9-13)14-11-27-18(19-14)20-17(22)10-25-16-5-3-2-4-15(16)21(23)24/h2-9,11H,10H2,1H3,(H,19,20,22)