Vitas-M small molecule compound
3-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(2-methoxyphenyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL051493
SMILES CCOCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2OC)/C1=O
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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 C29H33N5O4S2 MW 579.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O4S2/c1-4-38-17-7-12-33-28(36)24(40-29(33)39)18-21-26(30-25-11-10-20(2)19-34(25)27(21)35)32-15-13-31(14-16-32)22-8-5-6-9-23(22)37-3/h5-6,8-11,18-19H,4,7,12-17H2,1-3H3/b24-18-InChIKey
RZNYHFYDTXCMJB-MOHJPFBDSA-NSynonyms
(5Z)3(3ETHOXYPROPYL)5((2(4(2METHOXYPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(3ethoxypropyl)5((2(4(2methoxyphenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(3ethoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(2methoxyphenyl)piperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
3(3ETHOXYPROPYL)5((2(4(2METHOXYPHENYL)PIPERAZINYL)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
CCOCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)N4CCN(CC4)C5=CC=CC=C5OC)SC1=S
CCOCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2OC)C1=O
InChI=1SC29H33N5O4S2c1438177123328(36)24(4029(33)39)182126(3025111020(2)1934(25)27(21)35)32151331(141632)22856923(22)373h568111819H471217H213H3b2418
MFCD03665357
ZINC000097947690
ZINC97947690
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