4-[C-methyl-N-[2-(2-methylprop-2-enylimino)-4-(3-nitrophenyl)-1,3-thiazol-3-yl]carbonimidoyl]benzenecarbonitrile

Systemtic Name: 4-[C-methyl-N-[2-(2-methylprop-2-enylimino)-4-(3-nitrophenyl)-1,3-thiazol-3-yl]carbonimidoyl]benzenecarbonitrile Openeye Name: 4-[C-methyl-N-[2-(2-methylallylimino)-4-(3-nitrophenyl)thiazol-3-yl]carbonimidoyl]benzonitrile CAS Name: 4-[1-[[2-(2-methylprop-2-enylimino)-4-(3-nitrophenyl)-3-thiazolyl]imino]ethyl]benzonitrile IUPAC Name: 4-[C-methyl-N-[2-(2-methylprop-2-enylimino)-4-(3-nitrophenyl)-1,3-thiazol-3-yl]carbonimidoyl]benzonitrile Traditional Name: 4-[C-methyl-N-[2-(2-methylallylimino)-4-(3-nitrophenyl)-4-thiazolin-3-yl]carbonimidoyl]benzonitrile Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN=C1N(C(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])N=C(C)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(=C)CN=C1N(C(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])N=C(C)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H19N5O2S/c1-15(2)13-24-22-26(25-16(3)18-9-7-17(12-23)8-10-18)21(14-30-22)19-5-4-6-20(11-19)27(28)29/h4-11,14H,1,13H2,2-3H3