(E)-3-[(5-chloranyl-4-nitro-2-oxidanyl-phenyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[(5-chloranyl-4-nitro-2-oxidanyl-phenyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(5-chloro-2-hydroxy-4-nitro-anilino)-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(5-chloro-2-hydroxy-4-nitroanilino)-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(5-chloro-2-hydroxy-4-nitroanilino)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(5-chloro-2-hydroxy-4-nitro-anilino)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C13H9ClN4O3S MolecularWeight: 336.75356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CNC2=CC(=C(C=C2O)[N+](=O)[O-])Cl)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/NC2=CC(=C(C=C2O)[N+](=O)[O-])Cl)/C#N

InChI

InChI=1S/C13H9ClN4O3S/c1-7-6-22-13(17-7)8(4-15)5-16-10-2-9(14)11(18(20)21)3-12(10)19/h2-3,5-6,16,19H,1H3/b8-5+