3-methyl-5-[(4-nitrophenyl)amino]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-methyl-5-[(4-nitrophenyl)amino]-1,2-thiazole-4-carbonitrile Openeye Name: 3-methyl-5-(4-nitroanilino)isothiazole-4-carbonitrile CAS Name: 3-methyl-5-(4-nitroanilino)-4-isothiazolecarbonitrile IUPAC Name: 3-methyl-5-(4-nitroanilino)-1,2-thiazole-4-carbonitrile Traditional Name: 3-methyl-5-(4-nitroanilino)isothiazole-4-carbonitrile Formula: C11H8N4O2S MolecularWeight: 260.27182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C#N)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NSC(=C1C#N)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O2S/c1-7-10(6-12)11(18-14-7)13-8-2-4-9(5-3-8)15(16)17/h2-5,13H,1H3