2-phenoxyethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-phenoxyethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-phenoxyethyl 5-methyl-4-oxo-3-[2-oxo-2-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 5-methyl-4-oxo-3-[2-oxo-2-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(3-keto-4-propyl-1,4-benzoxazin-6-yl)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-phenoxyethyl ester Formula: C29H27N3O7S MolecularWeight: 561.60558

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)COC2=C1C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C(=C(S4)C(=O)OCCOC5=CC=CC=C5)C

Isomeric SMILES

CCCN1C(=O)COC2=C1C=C(C=C2)C(=O)CN3C=NC4=C(C3=O)C(=C(S4)C(=O)OCCOC5=CC=CC=C5)C

InChI

InChI=1S/C29H27N3O7S/c1-3-11-32-21-14-19(9-10-23(21)39-16-24(32)34)22(33)15-31-17-30-27-25(28(31)35)18(2)26(40-27)29(36)38-13-12-37-20-7-5-4-6-8-20/h4-10,14,17H,3,11-13,15-16H2,1-2H3