(E)-2-(4-methyl-1,3-thiazol-2-yl)-3-[(5-nitropyridin-2-yl)amino]prop-2-enenitrile

Systemtic Name: (E)-2-(4-methyl-1,3-thiazol-2-yl)-3-[(5-nitropyridin-2-yl)amino]prop-2-enenitrile Openeye Name: (E)-2-(4-methylthiazol-2-yl)-3-[(5-nitro-2-pyridyl)amino]prop-2-enenitrile CAS Name: (E)-2-(4-methyl-2-thiazolyl)-3-[(5-nitro-2-pyridinyl)amino]-2-propenenitrile IUPAC Name: (E)-2-(4-methyl-1,3-thiazol-2-yl)-3-[(5-nitropyridin-2-yl)amino]prop-2-enenitrile Traditional Name: (E)-2-(4-methylthiazol-2-yl)-3-[(5-nitro-2-pyridyl)amino]acrylonitrile Formula: C12H9N5O2S MolecularWeight: 287.29716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CNC2=NC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/NC2=NC=C(C=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C12H9N5O2S/c1-8-7-20-12(16-8)9(4-13)5-14-11-3-2-10(6-15-11)17(18)19/h2-3,5-7H,1H3,(H,14,15)/b9-5+