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

Systemtic Name: 2-[[3-(2-methyl-1,3-thiazol-4-yl)phenyl]amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[3-(2-methylthiazol-4-yl)anilino]-5-nitro-benzonitrile CAS Name: 2-[3-(2-methyl-4-thiazolyl)anilino]-5-nitrobenzonitrile IUPAC Name: 2-[3-(2-methyl-1,3-thiazol-4-yl)anilino]-5-nitrobenzonitrile Traditional Name: 2-[3-(2-methylthiazol-4-yl)anilino]-5-nitro-benzonitrile Formula: C17H12N4O2S MolecularWeight: 336.36778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H12N4O2S/c1-11-19-17(10-24-11)12-3-2-4-14(7-12)20-16-6-5-15(21(22)23)8-13(16)9-18/h2-8,10,20H,1H3