Vitas-M small molecule compound
N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Catalog ID
STK934146
SMILES COCc1n[nH]/c(=N\C(=O)c2noc3c2CCCCC3)/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 C13H16N4O3S MW 308.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N4O3S/c1-19-7-10-15-16-13(21-10)14-12(18)11-8-5-3-2-4-6-9(8)20-17-11/h2-7H2,1H3,(H,14,16,18)InChIKey
OLYHAJWNPFKGSV-UHFFFAOYSA-NSynonyms
1190261-11-01190261110
COCC1=NN=C(S1)NC(=O)C2=NOC3=C2CCCCC3
COCc1n(nH)c(=NC(=O)c2noc3c2CCCCC3)s1
InChI=1SC13H16N4O3Sc119710151613(2110)1412(18)118532469(8)201711h27H21H3(H141618)
MFCD18177717
N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)5678tetrahydro4Hcyclohepta(d)(12)oxazole3carboxamide
N(5(methoxymethyl)134thiadiazol2yl)5678tetrahydro4Hcyclohepta(d)(12)oxazole3carboxamide
ZINC000036360429
ZINC36360429
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