Vitas-M small molecule compound
(4-{(Z)-[6-(ethoxycarbonyl)-5-(3-methoxy-2-propoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}-2-methoxyphenoxy)acetic acid
Catalog ID
STK010282
SMILES CCCOc1c(OC)cccc1C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccc(c(c1)OC)OCC(=O)O)/s2)C(=O)OCC
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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 C30H32N2O9S MW 596.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O9S/c1-6-13-40-27-19(9-8-10-21(27)37-4)26-25(29(36)39-7-2)17(3)31-30-32(26)28(35)23(42-30)15-18-11-12-20(22(14-18)38-5)41-16-24(33)34/h8-12,14-15,26H,6-7,13,16H2,1-5H3,(H,33,34)/b23-15-InChIKey
GEJOEPAMWOJERN-HAHDFKILSA-NSynonyms
(4((Z)(6(ETHOXYCARBONYL)5(3METHOXY2PROPOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2(3H)YLIDENE)METHYL)2METHOXYPHENOXY)ACETICACID
2(4((Z)(6ETHOXYCARBONYL5(3METHOXY2PROPOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)2METHOXYPHENOXY)ACETICACID
CCCOC1=C(C=CC=C1OC)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(C=C4)OCC(=O)O)OC)S3)C)C(=O)OCC
CCCOc1c(OC)cccc1C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(c(c1)OC)OCC(=O)O)s2)C(=O)OCC
InChI=1SC30H32N2O9Sc1613402719(981021(27)374)2625(29(36)3972)17(3)313032(26)28(35)23(4230)1518111220(22(1418)385)411624(33)34h812141526H671316H215H3(H3334)b2315
MFCD08049364
STK010282
ZINC000097957858
ZINC000097957859
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