Vitas-M small molecule compound
6-[(5Z)-5-{[7-methyl-2-(4-methylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK704730
SMILES CN1CCN(CC1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCCCC(=O)O)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 C24H29N5O4S2 MW 515.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O4S2/c1-16-7-8-19-25-21(27-12-10-26(2)11-13-27)17(22(32)29(19)15-16)14-18-23(33)28(24(34)35-18)9-5-3-4-6-20(30)31/h7-8,14-15H,3-6,9-13H2,1-2H3,(H,30,31)/b18-14-InChIKey
ORYQQRIMNOXWQY-JXAWBTAJSA-NSynonyms
6((5Z)5((7methyl2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5((7METHYL2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)N4CCN(CC4)C)C=C1
CN1CCN(CC1)c1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)CCCCCC(=O)O)C
InChI=1SC24H29N5O4S2c11678192521(27121026(2)111327)17(22(32)29(19)1516)141823(33)28(24(34)3518)9534620(30)31h781415H36913H212H3(H3031)b1814
MFCD06642759
ZINC000016805825
ZINC16805825
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