ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[3-(1,3-benzothiazol-2-yl)-1-oxopropoxy]methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-keto-4-(4-methoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)COC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)COC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H25N3O6S/c1-3-33-24(30)22-18(27-25(31)28-23(22)15-8-10-16(32-2)11-9-15)14-34-21(29)13-12-20-26-17-6-4-5-7-19(17)35-20/h4-11,23H,3,12-14H2,1-2H3,(H2,27,28,31)