methyl 2-[5-[(E)-[1-(4-methylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoate

Systemtic Name: methyl 2-[5-[(E)-[1-(4-methylphenyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoate Openeye Name: methyl 2-[5-[(E)-[4,6-dioxo-1-(p-tolyl)-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]-2-furyl]benzoate CAS Name: 2-[5-[(E)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-[(E)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]furan-2-yl]benzoate Traditional Name: 2-[5-[(E)-[4,6-diketo-1-(p-tolyl)-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]-2-furyl]benzoic acid methyl ester Formula: C24H18N2O5S MolecularWeight: 446.47512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4C(=O)OC)C(=O)NC2=S

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC=CC=C4C(=O)OC)/C(=O)NC2=S

InChI

InChI=1S/C24H18N2O5S/c1-14-7-9-15(10-8-14)26-22(28)19(21(27)25-24(26)32)13-16-11-12-20(31-16)17-5-3-4-6-18(17)23(29)30-2/h3-13H,1-2H3,(H,25,27,32)/b19-13+