Vitas-M small molecule compound
N-(3,4-dimethoxyphenyl)-7-hydroxy-3-(thiophen-2-yl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrimidine-5-carboxamide
Catalog ID
STL245144
SMILES COc1ccc(cc1OC)NC(=O)C1CC(=Nc2n1c(nn2)c1cccs1)O
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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 C18H17N5O4S MW 399.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O4S/c1-26-12-6-5-10(8-13(12)27-2)19-17(25)11-9-15(24)20-18-22-21-16(23(11)18)14-4-3-7-28-14/h3-8,11H,9H2,1-2H3,(H,19,25)(H,20,22,24)InChIKey
SPRRMPKTWRIANI-UHFFFAOYSA-NSynonyms
1374512-46-51374512465
COC1=C(C=C(C=C1)NC(=O)C2CC(=O)N=C3N2C(=NN3)C4=CC=CS4)OC
InChI=1SC18H17N5O4Sc126126510(813(12)272)1917(25)11915(24)2018222116(23(11)18)144372814h3811H9H212H3(H1925)(H202224)
MFCD24860164
N(34dimethoxyphenyl)7hydroxy3(thiophen2yl)56dihydro(124)triazolo(43a)pyrimidine5carboxamide
N(34dimethoxyphenyl)7oxo3thiophen2yl56dihydro1H(124)triazolo(43a)pyrimidine5carboxamide
ZINC000072406433
ZINC000072406434
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