Vitas-M small molecule compound
3-[(Z)-(3-cyclohexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-(prop-2-en-1-ylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK816406
SMILES C=CCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCCCC1)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 C22H24N4O2S2 MW 440.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O2S2/c1-3-11-23-19-16(20(27)25-13-14(2)9-10-18(25)24-19)12-17-21(28)26(22(29)30-17)15-7-5-4-6-8-15/h3,9-10,12-13,15,23H,1,4-8,11H2,2H3/b17-12-InChIKey
OAEBYTYZTXVMGZ-ATVHPVEESA-NSynonyms
(5Z)3CYCLOHEXYL5((7METHYL4OXO2(PROP2ENYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3cyclohexyl4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2(prop2en1ylamino)4Hpyrido(12a)pyrimidin4one
C=CCNc1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCCCC1)C
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C4CCCCC4)NCC=C)C=C1
InChI=1SC22H24N4O2S2c1311231916(20(27)251314(2)91018(25)2419)121721(28)26(22(29)3017)157546815h391012131523H14811H22H3b1712
MFCD04446046
ZINC000016733353
ZINC16733353
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