Vitas-M small molecule compound
3-{(Z)-[3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-[(2-methylpropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881576
SMILES CC(CNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)c1c(=O)n(n(c1C)C)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 C28H28N6O3S2 MW 560.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O3S2/c1-16(2)15-29-23-20(25(35)32-13-9-10-17(3)24(32)30-23)14-21-26(36)33(28(38)39-21)22-18(4)31(5)34(27(22)37)19-11-7-6-8-12-19/h6-14,16,29H,15H2,1-5H3/b21-14-InChIKey
KDJCWOVWTGKSEF-STZFKDTASA-NSynonyms
(5Z)3(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)5((9METHYL2(2METHYLPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)5((2(isobutylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2((2methylpropyl)amino)4Hpyrido(12a)pyrimidin4one
CC(CNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)c1c(=O)n(n(c1C)C)c1ccccc1)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C)NCC(C)C
InChI=1SC28H28N6O3S2c116(2)15292320(25(35)321391017(3)24(32)3023)142126(36)33(28(38)3921)2218(4)31(5)34(27(22)37)19117681219h6141629H15H215H3b2114
MFCD03690827
ZINC000097947260
ZINC97947260
Check stock
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