Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Catalog ID
STK720486
SMILES O=C(Nc1ccc(cc1)C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)Cl)CCCC3
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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 C26H22ClN5O2S2 MW 536.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O2S2/c1-15-6-10-17(11-7-15)28-21(33)14-35-26-30-29-25-31(18-12-8-16(27)9-13-18)23(34)22-19-4-2-3-5-20(19)36-24(22)32(25)26/h6-13H,2-5,14H2,1H3,(H,28,33)InChIKey
UECDERCEVDOAAE-UHFFFAOYSA-NSynonyms
577962-94-82((4(4chlorophenyl)5oxo456789hexahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)N(4methylphenyl)acetamide
2((4(4chlorophenyl)5oxo456789hexahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)N(ptolyl)acetamide
577962948
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCCC5)C(=O)N3C6=CC=C(C=C6)Cl
InChI=1SC26H22ClN5O2S2c11561017(11715)2821(33)14352630292531(1812816(27)91318)23(34)2219423520(19)3624(22)32(25)26h613H2514H21H3(H2833)
MFCD04028769
ZINC000002385242
ZINC2385242
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