methyl 4-[4-phenyl-2-(C-pyrazin-2-ylcarbonimidoyl)imino-1,3-thiazol-3-yl]benzoate

Systemtic Name: methyl 4-[4-phenyl-2-(C-pyrazin-2-ylcarbonimidoyl)imino-1,3-thiazol-3-yl]benzoate Openeye Name: methyl 4-[4-phenyl-2-(pyrazine-2-carboximidoylimino)thiazol-3-yl]benzoate CAS Name: 4-[2-[imino(2-pyrazinyl)methyl]imino-4-phenyl-3-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-phenyl-2-(pyrazine-2-carboximidoylimino)-1,3-thiazol-3-yl]benzoate Traditional Name: 4-[4-phenyl-2-(pyrazine-2-carboximidoylimino)-4-thiazolin-3-yl]benzoic acid methyl ester Formula: C22H17N5O2S MolecularWeight: 415.46768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=CSC2=NC(=N)C3=NC=CN=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=CSC2=NC(=N)C3=NC=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N5O2S/c1-29-21(28)16-7-9-17(10-8-16)27-19(15-5-3-2-4-6-15)14-30-22(27)26-20(23)18-13-24-11-12-25-18/h2-14,23H,1H3