SpectraBase Spectrum ID |
FfZWjGWxdmW |
Name |
4-(3-nitrophenyl)-2-oxo-6-[(phenylmethylthio)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H21N3O5S |
InChI |
InChI=1S/C21H21N3O5S/c1-2-29-20(25)18-17(13-30-12-14-7-4-3-5-8-14)22-21(26)23-19(18)15-9-6-10-16(11-15)24(27)28/h3-11,19H,2,12-13H2,1H3,(H2,22,23,26) |
InChIKey |
JFQBCFZHRXSLOQ-UHFFFAOYSA-N |
Molecular Weight |
427.475 g/mol |
SMILES |
N1C(C(=C(NC1=O)CSCc1ccccc1)C(=O)OCC)c1cc(N(=O)=O)ccc1 |
SPLASH |
splash10-0006-9311000000-3b1bc4b43caf98288500 |
Synonyms |
6-[(benzylthio)methyl]-2-keto-4-(3-nitrophenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
Ethyl 4-(3-nitrophenyl)-2-oxidanylidene-6-[(phenylmethylsulfanyl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate
Ethyl 6-(benzylsulfanylmethyl)-4-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate |
Wiley ID |
1512497 |