Vitas-M small molecule compound
N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1-(propan-2-yl)-1,5,6,7-tetrahydrocyclopenta[b]pyrazolo[4,3-e]pyridine-4-carboxamide
Catalog ID
STK930895
SMILES COCc1n[nH]/c(=N\C(=O)c2c3CCCc3nc3c2cnn3C(C)C)/s1
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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 C17H20N6O2S MW 372.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N6O2S/c1-9(2)23-15-11(7-18-23)14(10-5-4-6-12(10)19-15)16(24)20-17-22-21-13(26-17)8-25-3/h7,9H,4-6,8H2,1-3H3,(H,20,22,24)InChIKey
AUHSHPFSZCFINK-UHFFFAOYSA-NSynonyms
1179478-14-81179478148
CC(C)N1C2=NC3=C(CCC3)C(=C2C=N1)C(=O)NC4=NN=C(S4)COC
COCc1n(nH)c(=NC(=O)c2c3CCCc3nc3c2cnn3C(C)C)s1
InChI=1SC17H20N6O2Sc19(2)231511(71823)14(1054612(10)1915)16(24)2017222113(2617)8253h79H468H213H3(H202224)
MFCD18176782
N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)1(propan2yl)1567tetrahydrocyclopenta(b)pyrazolo(43e)pyridine4carboxamide
ZINC000035686436
ZINC35686436
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