ethyl 7-methyl-3-oxidanylidene-5-(4-propan-2-ylphenyl)-2-[(4-prop-2-ynoxyphenyl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 7-methyl-3-oxidanylidene-5-(4-propan-2-ylphenyl)-2-[(4-prop-2-ynoxyphenyl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl 5-(4-isopropylphenyl)-7-methyl-3-oxo-2-[(4-prop-2-ynoxyphenyl)methylene]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 7-methyl-3-oxo-5-(4-propan-2-ylphenyl)-2-[(4-prop-2-ynoxyphenyl)methylidene]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 7-methyl-3-oxo-5-(4-propan-2-ylphenyl)-2-[(4-prop-2-ynoxyphenyl)methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 3-keto-7-methyl-5-p-cumenyl-2-(4-propargyloxybenzylidene)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C29H28N2O4S MolecularWeight: 500.60862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC#C)S2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC#C)S2)C

InChI

InChI=1S/C29H28N2O4S/c1-6-16-35-23-14-8-20(9-15-23)17-24-27(32)31-26(22-12-10-21(11-13-22)18(3)4)25(28(33)34-7-2)19(5)30-29(31)36-24/h1,8-15,17-18,26H,7,16H2,2-5H3