2-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[1-(2-methylthiazol-4-yl)ethylamino]-5-nitro-benzonitrile CAS Name: 2-[1-(2-methyl-4-thiazolyl)ethylamino]-5-nitrobenzonitrile IUPAC Name: 2-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]-5-nitrobenzonitrile Traditional Name: 2-[1-(2-methylthiazol-4-yl)ethylamino]-5-nitro-benzonitrile Formula: C13H12N4O2S MolecularWeight: 288.32498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(C)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=NC(=CS1)C(C)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H12N4O2S/c1-8(13-7-20-9(2)16-13)15-12-4-3-11(17(18)19)5-10(12)6-14/h3-5,7-8,15H,1-2H3