Vitas-M small molecule compound

2-[(3-hydroxypropyl)amino]-3-[(Z)-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STL363436
SMILES OCCCNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccc(cc1)OC)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 C25H26N4O4S2 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4S2/c1-16-4-9-21-27-22(26-11-3-13-30)19(23(31)29(21)15-16)14-20-24(32)28(25(34)35-20)12-10-17-5-7-18(33-2)8-6-17/h4-9,14-15,26,30H,3,10-13H2,1-2H3/b20-14-
InChIKey
HRCQHSAZCASYOQ-ZHZULCJRSA-N
Synonyms
615275-81-5
(5Z)5((2(3HYDROXYPROPYLAMINO)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(2(4METHOXYPHENYL)ETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3hydroxypropyl)amino)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(4methoxyphenethyl)2thioxothiazolidin4one
2((3hydroxypropyl)amino)3((Z)(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl4Hpyrido(12a)pyrimidin4one
5((2((3HYDROXYPROPYL)AMINO)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3(2(4METHOXYPHENYL)ETHYL)2THIOXO13THIAZOLIDIN4ONE
615275815
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=C(C=C4)OC)NCCCO)C=C1
InChI=1SC25H26N4O4S2c11649212722(261131330)19(23(31)29(21)1516)142024(32)28(25(34)3520)1210175718(332)8617h4914152630H31013H212H3b2014
MFCD03663888
OCCCNc1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)CCc1ccc(cc1)OC)C
ZINC000012112408
ZINC12112408

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Available files

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