Vitas-M small molecule compound
2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(Z)-pyridin-3-ylmethylidene]acetohydrazide
Catalog ID
STL146276
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)N/N=C\c1cccnc1
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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 C25H23N5O2S2 MW 489.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O2S2/c1-16-8-10-18(11-9-16)30-24(32)22-19-6-2-3-7-20(19)34-23(22)28-25(30)33-15-21(31)29-27-14-17-5-4-12-26-13-17/h4-5,8-14H,2-3,6-7,15H2,1H3,(H,29,31)/b27-14-InChIKey
KZZNWNKHQXJYLX-VYYCAZPPSA-NSynonyms
(E)2((4oxo3(ptolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(pyridin3ylmethylene)acetohydrazide
2((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N((Z)pyridin3ylmethylidene)acetohydrazide
2((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N((Z)pyridin3ylmethylideneamino)acetamide
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NN=CC4=CN=CC=C4)SC5=C3CCCC5
InChI=1SC25H23N5O2S2c11681018(11916)3024(32)2219623720(19)3423(22)2825(30)331521(31)292714175412261317h45814H236715H21H3(H2931)b2714
MFCD03217764
O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)NN=Cc1cccnc1
ZINC000031830550
ZINC00949931
ZINC949931
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