Vitas-M small molecule compound
6-[(5Z)-5-({2-[(2-hydroxy-2-phenylethyl)amino]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK905627
SMILES OC(=O)CCCCCN1C(=S)S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3C)/C1=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 C27H28N4O5S2 MW 552.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O5S2/c1-17-9-8-14-30-24(17)29-23(28-16-20(32)18-10-4-2-5-11-18)19(25(30)35)15-21-26(36)31(27(37)38-21)13-7-3-6-12-22(33)34/h2,4-5,8-11,14-15,20,28,32H,3,6-7,12-13,16H2,1H3,(H,33,34)/b21-15-InChIKey
GLBOLZDLYLYRSZ-QNGOZBTKSA-NSynonyms
713090-81-4(Z)6(5((2((2hydroxy2phenylethyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)hexanoicacid
6((5Z)5((2((2hydroxy2phenylethyl)amino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5((2((2HYDROXY2PHENYLETHYL)AMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
713090814
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)NCC(C4=CC=CC=C4)O
InChI=1SC27H28N4O5S2c11798143024(17)2923(281620(32)18104251118)19(25(30)35)152126(36)31(27(37)3821)137361222(33)34h2458111415202832H367121316H21H3(H3334)b2115
MFCD05725215
OC(=O)CCCCCN1C(=S)SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3C)C1=O
ZINC000097947410
ZINC000097947411
Check stock
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