Vitas-M small molecule compound
N-benzyl-2-[(5-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]propanamide
Catalog ID
STL226907
SMILES O=C(C(Sc1nnc2n1c(C)nc1c2c2CCCCc2s1)C)NCc1ccccc1
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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 C22H23N5OS2 MW 437.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5OS2/c1-13(20(28)23-12-15-8-4-3-5-9-15)29-22-26-25-19-18-16-10-6-7-11-17(16)30-21(18)24-14(2)27(19)22/h3-5,8-9,13H,6-7,10-12H2,1-2H3,(H,23,28)InChIKey
RLMINNRXMRNCMU-UHFFFAOYSA-NSynonyms
672268-04-1672268041
CC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N14)SC(C)C(=O)NCC5=CC=CC=C5
InChI=1SC22H23N5OS2c113(20(28)2312158435915)2922262519181610671117(16)3021(18)2414(2)27(19)22h358913H671012H212H3(H2328)
MFCD03802403
Nbenzyl2((5methyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)propanamide
Nbenzyl2((5methyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)propanamide
ZINC000001241317
ZINC000001241318
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