4-azanyl-2-(dicyanomethylidene)-3-phenyl-N-[(E)-1-phenylethylideneamino]-1,3-thiazole-5-carboxamide

Systemtic Name: 4-azanyl-2-(dicyanomethylidene)-3-phenyl-N-[(E)-1-phenylethylideneamino]-1,3-thiazole-5-carboxamide Openeye Name: 4-amino-2-(dicyanomethylene)-3-phenyl-N-[(E)-1-phenylethylideneamino]thiazole-5-carboxamide CAS Name: 4-amino-2-(dicyanomethylidene)-3-phenyl-N-[(E)-1-phenylethylideneamino]-5-thiazolecarboxamide IUPAC Name: 4-amino-2-(dicyanomethylidene)-3-phenyl-N-[(E)-1-phenylethylideneamino]-1,3-thiazole-5-carboxamide Traditional Name: 4-amino-2-(dicyanomethylene)-3-phenyl-N-[(E)-1-phenylethylideneamino]-4-thiazoline-5-carboxamide Formula: C21H16N6OS MolecularWeight: 400.45634

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(N(C(=C(C#N)C#N)S1)C2=CC=CC=C2)N)C3=CC=CC=C3

Isomeric SMILES

C/C(=N\NC(=O)C1=C(N(C(=C(C#N)C#N)S1)C2=CC=CC=C2)N)/C3=CC=CC=C3

InChI

InChI=1S/C21H16N6OS/c1-14(15-8-4-2-5-9-15)25-26-20(28)18-19(24)27(17-10-6-3-7-11-17)21(29-18)16(12-22)13-23/h2-11H,24H2,1H3,(H,26,28)/b25-14+