Vitas-M small molecule compound
2-methylpropyl (2Z)-7-methyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK799085
SMILES CC(COC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccc(o1)c1ccccc1[N+](=O)[O-])/s2)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H23N3O6S2 MW 549.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O6S2/c1-15(2)14-35-26(32)23-16(3)28-27-29(24(23)21-9-6-12-37-21)25(31)22(38-27)13-17-10-11-20(36-17)18-7-4-5-8-19(18)30(33)34/h4-13,15,24H,14H2,1-3H3/b22-13-InChIKey
GQWDCKVIKATTLT-XKZIYDEJSA-NSynonyms
2methylpropyl(2Z)7methyl2((5(2nitrophenyl)furan2yl)methylidene)3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
2METHYLPROPYL(2Z)7METHYL2((5(2NITROPHENYL)FURAN2YL)METHYLIDENE)3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
CC(COC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1ccc(o1)c1ccccc1(N+)(=O)(O))s2)C
CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4(N+)(=O)(O))SC2=N1)C5=CC=CS5)C(=O)OCC(C)C
InChI=1SC27H23N3O6S2c115(2)143526(32)2316(3)282729(24(23)2196123721)25(31)22(3827)1317101120(3617)18745819(18)30(33)34h4131524H14H213H3b2213
MFCD03462259
ZINC000002671787
ZINC000002671789
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.