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}-7-methyl-2-phenoxy-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK705128
SMILES Cc1ccc2n(c1)c(=O)c(c(n2)Oc1ccccc1)/C=C/1\SC(=S)N(C1=O)c1c(=O)n(n(c1C)C)c1ccccc1

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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/c1-18-14-15-24-31-26(39-21-12-8-5-9-13-21)22(27(36)33(24)17-18)16-23-28(37)34(30(40)41-23)25-19(2)32(3)35(29(25)38)20-10-6-4-7-11-20/h4-17H,1-3H3/b23-16-
InChIKey
IFVSKWYVCGVMHX-KQWNVCNZSA-N
Synonyms

(5Z)3(15dimethyl3oxo2phenylpyrazol4yl)5((7methyl4oxo2phenoxypyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2phenoxy4Hpyrido(12a)pyrimidin4one
CC1=CN2C(=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)C=C1
Cc1ccc2n(c1)c(=O)c(c(n2)Oc1ccccc1)C=C1SC(=S)N(C1=O)c1c(=O)n(n(c1C)C)c1ccccc1
InChI=1SC30H23N5O4S2c1181415243126(3921128591321)22(27(36)33(24)1718)162328(37)34(30(40)4123)2519(2)32(3)35(29(25)38)20106471120h417H13H3b2316
MFCD04484396
ZINC000097946614
ZINC97946614

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Available files

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