Vitas-M small molecule compound
6-[(5Z)-5-({9-methyl-2-[(morpholin-4-ylmethyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK796855
SMILES OC(=O)CCCCCN1C(=S)S/C(=C\c2c(NCN3CCOCC3)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 C24H29N5O5S2 MW 531.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O5S2/c1-16-6-5-9-28-21(16)26-20(25-15-27-10-12-34-13-11-27)17(22(28)32)14-18-23(33)29(24(35)36-18)8-4-2-3-7-19(30)31/h5-6,9,14,25H,2-4,7-8,10-13,15H2,1H3,(H,30,31)/b18-14-InChIKey
MKGUNUMDHUGIPF-JXAWBTAJSA-NSynonyms
6((5Z)5((9methyl2((morpholin4ylmethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5((9METHYL2(MORPHOLIN4YLMETHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)NCN4CCOCC4
InChI=1SC24H29N5O5S2c1166592821(16)2620(251527101234131127)17(22(28)32)141823(33)29(24(35)3618)8423719(30)31h5691425H2478101315H21H3(H3031)b1814
MFCD03225748
OC(=O)CCCCCN1C(=S)SC(=Cc2c(NCN3CCOCC3)nc3n(c2=O)cccc3C)C1=O
ZINC000100836856
ZINC100836856
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