Vitas-M small molecule compound
2-{[4-(2-methoxyphenyl)-5-oxo-4,5,7,8-tetrahydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Catalog ID
STK722259
SMILES COc1ccccc1n1c(=O)c2c3CCCc3sc2n2c1nnc2SCC(=O)Nc1ccc(cc1)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 C26H23N5O3S2 MW 517.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O3S2/c1-15-10-12-16(13-11-15)27-21(32)14-35-26-29-28-25-30(18-7-3-4-8-19(18)34-2)23(33)22-17-6-5-9-20(17)36-24(22)31(25)26/h3-4,7-8,10-13H,5-6,9,14H2,1-2H3,(H,27,32)InChIKey
KBXATOPMYQSTAR-UHFFFAOYSA-NSynonyms
2((4(2methoxyphenyl)5oxo4578tetrahydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)N(4methylphenyl)acetamide
2((4(2methoxyphenyl)5oxo5678tetrahydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)N(ptolyl)acetamide
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C4=C(C5=C(S4)CCC5)C(=O)N3C6=CC=CC=C6OC
InChI=1SC26H23N5O3S2c115101216(131115)2721(32)14352629282530(18734819(18)342)23(33)221765920(17)3624(22)31(25)26h34781013H56914H212H3(H2732)
MFCD02987705
ZINC000000986142
ZINC00986142
ZINC986142
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