methyl 4-[[4,6-bis(oxidanylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[[4,6-bis(oxidanylidene)-1,3-diphenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[(4,6-dioxo-1,3-diphenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]benzoate CAS Name: 4-[(4,6-dioxo-1,3-diphenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4,6-dioxo-1,3-diphenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]benzoate Traditional Name: 4-[(4,6-diketo-1,3-diphenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]benzoic acid methyl ester Formula: C25H18N2O4S MolecularWeight: 442.48642

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H18N2O4S/c1-31-24(30)18-14-12-17(13-15-18)16-21-22(28)26(19-8-4-2-5-9-19)25(32)27(23(21)29)20-10-6-3-7-11-20/h2-16H,1H3