ethyl 1,3-bis[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-6-methyl-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1,3-bis[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-6-methyl-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 1,3-bis[(1,3-dioxoisoindolin-2-yl)methyl]-6-methyl-4-phenyl-2-thioxo-4H-pyrimidine-5-carboxylate CAS Name: 1,3-bis[(1,3-dioxo-2-isoindolyl)methyl]-6-methyl-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1,3-bis[(1,3-dioxoisoindol-2-yl)methyl]-6-methyl-4-phenyl-2-sulfanylidene-4H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-4-phenyl-1,3-bis(phthalimidomethyl)-2-thioxo-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C32H26N4O6S MolecularWeight: 594.63704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=CC=C2)CN3C(=O)C4=CC=CC=C4C3=O)CN5C(=O)C6=CC=CC=C6C5=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=CC=C2)CN3C(=O)C4=CC=CC=C4C3=O)CN5C(=O)C6=CC=CC=C6C5=O)C

InChI

InChI=1S/C32H26N4O6S/c1-3-42-31(41)25-19(2)33(17-35-27(37)21-13-7-8-14-22(21)28(35)38)32(43)34(26(25)20-11-5-4-6-12-20)18-36-29(39)23-15-9-10-16-24(23)30(36)40/h4-16,26H,3,17-18H2,1-2H3