Vitas-M small molecule compound
[(5Z)-5-({2-[4-(2-hydroxyethyl)piperazin-1-yl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK820173
SMILES OCCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC(=O)O
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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 C21H23N5O5S2 MW 489.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O5S2/c1-13-3-2-4-25-17(13)22-18(24-7-5-23(6-8-24)9-10-27)14(19(25)30)11-15-20(31)26(12-16(28)29)21(32)33-15/h2-4,11,27H,5-10,12H2,1H3,(H,28,29)/b15-11-InChIKey
NJNYUNMJFLRDRF-PTNGSMBKSA-NSynonyms
((5Z)5((2(4(2hydroxyethyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5Z)5((2(4(2HYDROXYETHYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2((5Z)5((2(4(2HYDROXYETHYL)PIPERAZIN4IUM1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETATE
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC(=O)(O))N4CC(NH+)(CC4)CCO
InChI=1SC21H23N5O5S2c1133242517(13)2218(247523(6824)91027)14(19(25)30)111520(31)26(1216(28)29)21(32)3315h241127H51012H21H3(H2829)b1511
MFCD06644885
OCCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CC(=O)O
ZINC000016741406
ZINC16741406
Check stock
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