Vitas-M small molecule compound
2-(butan-2-yl)-N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Catalog ID
STK656394
SMILES COCc1n[nH]/c(=N\C(=O)c2ccc3c(c2)C(=O)N(C3=O)C(CC)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 C17H18N4O4S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O4S/c1-4-9(2)21-15(23)11-6-5-10(7-12(11)16(21)24)14(22)18-17-20-19-13(26-17)8-25-3/h5-7,9H,4,8H2,1-3H3,(H,18,20,22)InChIKey
LIMKFTCZKKRACG-UHFFFAOYSA-NSynonyms
1144494-56-31144494563
2(butan2yl)N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)13dioxo23dihydro1Hisoindole5carboxamide
2butan2ylN(5(methoxymethyl)134thiadiazol2yl)13dioxoisoindole5carboxamide
CCC(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NN=C(S3)COC
COCc1n(nH)c(=NC(=O)c2ccc3c(c2)C(=O)N(C3=O)C(CC)C)s1
InChI=1SC17H18N4O4Sc149(2)2115(23)116510(712(11)16(21)24)14(22)1817201913(2617)8253h579H48H213H3(H182022)
MFCD18167678
ZINC000031808146
ZINC000031808150
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