methyl 7-methyl-2-[[2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: methyl 7-methyl-2-[[2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl 7-methyl-2-[[2-[(4-nitrophenyl)methoxy]phenyl]methylene]-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 7-methyl-2-[[2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 7-methyl-2-[[2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 3-keto-7-methyl-2-[2-(4-nitrobenzyl)oxybenzylidene]-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C29H23N3O6S MolecularWeight: 541.57442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3OCC4=CC=C(C=C4)[N+](=O)[O-])SC2=N1)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3OCC4=CC=C(C=C4)[N+](=O)[O-])SC2=N1)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C29H23N3O6S/c1-18-25(28(34)37-2)26(20-8-4-3-5-9-20)31-27(33)24(39-29(31)30-18)16-21-10-6-7-11-23(21)38-17-19-12-14-22(15-13-19)32(35)36/h3-16,26H,17H2,1-2H3