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

Systemtic Name: methyl 7-methyl-5-(4-nitrophenyl)-3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl 7-methyl-5-(4-nitrophenyl)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 7-methyl-5-(4-nitrophenyl)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 7-methyl-5-(4-nitrophenyl)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 3-keto-7-methyl-5-(4-nitrophenyl)-2-(3,4,5-trimethoxybenzylidene)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C25H23N3O8S MolecularWeight: 525.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OC)OC)SC2=N1)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(N2C(=O)C(=CC3=CC(=C(C(=C3)OC)OC)OC)SC2=N1)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C25H23N3O8S/c1-13-20(24(30)36-5)21(15-6-8-16(9-7-15)28(31)32)27-23(29)19(37-25(27)26-13)12-14-10-17(33-2)22(35-4)18(11-14)34-3/h6-12,21H,1-5H3