Vitas-M small molecule compound

6-(2,6-dimethylmorpholin-4-yl)-1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,2-dihydropyridine-3-carbonitrile

Catalog ID
STL004319
SMILES N#Cc1c(C)c(/C=C/2\SC(=S)N(C2=O)CCCc2ccccc2)c(n(c1=O)C)N1CC(C)OC(C1)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 C27H30N4O3S2 MW 522.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O3S2/c1-17-15-30(16-18(2)34-17)24-21(19(3)22(14-28)25(32)29(24)4)13-23-26(33)31(27(35)36-23)12-8-11-20-9-6-5-7-10-20/h5-7,9-10,13,17-18H,8,11-12,15-16H2,1-4H3/b23-13-
InChIKey
OOXWTQXLQKSKJL-QRVIBDJDSA-N
Synonyms
619267-58-2
(Z)6(26dimethylmorpholino)14dimethyl2oxo5((4oxo3(3phenylpropyl)2thioxothiazolidin5ylidene)methyl)12dihydropyridine3carbonitrile
6(26DIMETHYLMORPHOLIN4YL)14DIMETHYL2OXO5((Z)(4OXO3(3PHENYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDINE3CARBONITRILE
6(26dimethylmorpholin4yl)14dimethyl2oxo5((Z)(4oxo3(3phenylpropyl)2thioxo13thiazolidin5ylidene)methyl)12dihydropyridine3carbonitrile
619267582
CC1CN(CC(O1)C)C2=C(C(=C(C(=O)N2C)C#N)C)C=C3C(=O)N(C(=S)S3)CCCC4=CC=CC=C4
InChI=1SC27H30N4O3S2c1171530(1618(2)3417)2421(19(3)22(1428)25(32)29(24)4)132326(33)31(27(35)3623)128112096571020h57910131718H811121516H214H3b2313
MFCD03691278
N#Cc1c(C)c(C=C2SC(=S)N(C2=O)CCCc2ccccc2)c(n(c1=O)C)N1CC(C)OC(C1)C
ZINC000009462780
ZINC000018228589

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Available files

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