Vitas-M small molecule compound

N'-{(Z)-[3-(benzyloxy)phenyl]methylidene}-2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetohydrazide

Catalog ID
STL407143
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)N/N=C\c1cccc(c1)OCc1ccccc1

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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 C33H30N4O3S2 MW 594.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N4O3S2/c1-22-14-16-25(17-15-22)37-32(39)30-27-12-5-6-13-28(27)42-31(30)35-33(37)41-21-29(38)36-34-19-24-10-7-11-26(18-24)40-20-23-8-3-2-4-9-23/h2-4,7-11,14-19H,5-6,12-13,20-21H2,1H3,(H,36,38)/b34-19-
InChIKey
ZDKGLDBKCDOLBZ-FZKWRIDDSA-N
Synonyms

(E)N(3(benzyloxy)benzylidene)2((4oxo3(ptolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetohydrazide
2((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N((Z)(3phenylmethoxyphenyl)methylideneamino)acetamide
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NN=CC4=CC(=CC=C4)OCC5=CC=CC=C5)SC6=C3CCCC6
InChI=1SC33H30N4O3S2c122141625(171522)3732(39)302712561328(27)4231(30)3533(37)412129(38)363419241071126(1824)4020238324923h247111419H5612132021H21H3(H3638)b3419
MFCD03217756
N((Z)(3(benzyloxy)phenyl)methylidene)2((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetohydrazide
O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)NN=Cc1cccc(c1)OCc1ccccc1
ZINC000100852467
ZINC2594260

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Available files

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