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-phenoxy-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK905723
SMILES O=c1c(/C=C/2\SC(=S)N(C2=O)c2c(=O)n(n(c2C)C)c2ccccc2)c(Oc2ccccc2)nc2n1cccc2C
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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 C30H23N5O4S2 MW 581.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N5O4S2/c1-18-11-10-16-33-25(18)31-26(39-21-14-8-5-9-15-21)22(27(33)36)17-23-28(37)34(30(40)41-23)24-19(2)32(3)35(29(24)38)20-12-6-4-7-13-20/h4-17H,1-3H3/b23-17-InChIKey
CDMBXHHACOHBAM-QJOMJCCJSA-NSynonyms
(5Z)3(15dimethyl3oxo2phenylpyrazol4yl)5((9methyl4oxo2phenoxypyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2phenoxy4Hpyrido(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=CC=C6
InChI=1SC30H23N5O4S2c1181110163325(18)3126(3921148591521)22(27(33)36)172328(37)34(30(40)4123)2419(2)32(3)35(29(24)38)20126471320h417H13H3b2317
MFCD18076301
O=c1c(C=C2SC(=S)N(C2=O)c2c(=O)n(n(c2C)C)c2ccccc2)c(Oc2ccccc2)nc2n1cccc2C
ZINC000097947416
ZINC97947416
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