Vitas-M small molecule compound
2-(4-chlorophenoxy)-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-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK818673
SMILES Clc1ccc(cc1)Oc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)c1c(C)n(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 C30H22ClN5O4S2 MW 616.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22ClN5O4S2/c1-17-8-7-15-34-25(17)32-26(40-21-13-11-19(31)12-14-21)22(27(34)37)16-23-28(38)35(30(41)42-23)24-18(2)33(3)36(29(24)39)20-9-5-4-6-10-20/h4-16H,1-3H3/b23-16-InChIKey
FHDGCTUDJNXCPZ-KQWNVCNZSA-NSynonyms
(5Z)5((2(4chlorophenoxy)9methyl4oxopyrido(12a)pyrimidin3yl)methylidene)3(15dimethyl3oxo2phenylpyrazol4yl)2sulfanylidene13thiazolidin4one
2(4chlorophenoxy)3((Z)(3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4Hpyrido(12a)pyrimidin4one
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)OC6=CC=C(C=C6)Cl
Clc1ccc(cc1)Oc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
InChI=1SC30H22ClN5O4S2c11787153425(17)3226(4021131119(31)121421)22(27(34)37)162328(38)35(30(41)4223)2418(2)33(3)36(29(24)39)2095461020h416H13H3b2316
MFCD06643143
ZINC000097946758
ZINC97946758
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