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

Systemtic Name: (E)-3-[(2-methyl-3-nitro-phenyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-methyl-3-nitro-anilino)-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(2-methyl-3-nitroanilino)-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(2-methyl-3-nitroanilino)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-methyl-3-nitro-anilino)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N4O2S/c1-9-8-21-14(17-9)11(6-15)7-16-12-4-3-5-13(10(12)2)18(19)20/h3-5,7-8,16H,1-2H3/b11-7+