Vitas-M small molecule compound
ethyl (2Z)-2-(1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK111422
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/1\c3ccccc3N(C1=O)Cc1ccccc1)/s2
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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 C29H23N3O4S2 MW 541.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O4S2/c1-3-36-28(35)22-17(2)30-29-32(24(22)21-14-9-15-37-21)27(34)25(38-29)23-19-12-7-8-13-20(19)31(26(23)33)16-18-10-5-4-6-11-18/h4-15,24H,3,16H2,1-2H3/b25-23-InChIKey
QOVABTZWJWXZGF-BZZOAKBMSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=C1c3ccccc3N(C1=O)Cc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=C4C5=CC=CC=C5N(C4=O)CC6=CC=CC=C6)S2)C
ETHYL(2Z)2(1BENZYL2OXO12DIHYDRO3HINDOL3YLIDENE)7METHYL3OXO5(THIOPHEN2YL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(1benzyl2oxoindol3ylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC29H23N3O4S2c133628(35)2217(2)302932(24(22)21149153721)27(34)25(3829)231912781320(19)31(26(23)33)1618105461118h41524H316H212H3b2523
MFCD04127387
ZINC000003766360
ZINC000003766362
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