ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[[5-(3-ethoxycarbonylphenyl)furan-2-yl]methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[[5-(3-ethoxycarbonylphenyl)furan-2-yl]methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[[5-(3-ethoxycarbonylphenyl)-2-furyl]methylene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: (2Z)-5-(1,3-benzodioxol-5-yl)-2-[[5-(3-ethoxycarbonylphenyl)-2-furanyl]methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[[5-(3-ethoxycarbonylphenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: (2Z)-5-(1,3-benzodioxol-5-yl)-2-[[5-(3-carbethoxyphenyl)-2-furyl]methylene]-3-keto-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C31H26N2O8S MolecularWeight: 586.61174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)/C=C\3/C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C31H26N2O8S/c1-4-37-29(35)20-8-6-7-18(13-20)22-12-10-21(41-22)15-25-28(34)33-27(19-9-11-23-24(14-19)40-16-39-23)26(30(36)38-5-2)17(3)32-31(33)42-25/h6-15,27H,4-5,16H2,1-3H3/b25-15-