ethyl 2-(1-heptyl-2-oxidanylidene-indol-3-ylidene)-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-(1-heptyl-2-oxidanylidene-indol-3-ylidene)-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl 2-(1-heptyl-2-oxo-indolin-3-ylidene)-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 2-(1-heptyl-2-oxo-3-indolylidene)-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(1-heptyl-2-oxoindol-3-ylidene)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 2-(1-heptyl-2-keto-indolin-3-ylidene)-3-keto-7-methyl-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C31H33N3O4S MolecularWeight: 543.67642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C5=CC=CC=C5)C1=O

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C5=CC=CC=C5)C1=O

InChI

InChI=1S/C31H33N3O4S/c1-4-6-7-8-14-19-33-23-18-13-12-17-22(23)25(28(33)35)27-29(36)34-26(21-15-10-9-11-16-21)24(30(37)38-5-2)20(3)32-31(34)39-27/h9-13,15-18,26H,4-8,14,19H2,1-3H3