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

Systemtic Name: methyl 4-[4-phenyl-2-(C-pyridin-4-ylcarbonimidoyl)imino-1,3-thiazol-3-yl]benzoate Openeye Name: methyl 4-[4-phenyl-2-(pyridine-4-carboximidoylimino)thiazol-3-yl]benzoate CAS Name: 4-[2-[imino(pyridin-4-yl)methyl]imino-4-phenyl-3-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-phenyl-2-(pyridine-4-carboximidoylimino)-1,3-thiazol-3-yl]benzoate Traditional Name: 4-[4-phenyl-2-(pyridine-4-carboximidoylimino)-4-thiazolin-3-yl]benzoic acid methyl ester Formula: C23H18N4O2S MolecularWeight: 414.47962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18N4O2S/c1-29-22(28)18-7-9-19(10-8-18)27-20(16-5-3-2-4-6-16)15-30-23(27)26-21(24)17-11-13-25-14-12-17/h2-15,24H,1H3