Vitas-M small molecule compound
N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(3-methylbutyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Catalog ID
STK654111
SMILES COCc1n[nH]/c(=N\C(=O)c2ccc3c(c2)C(=O)N(C3=O)CCC(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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-10(2)6-7-22-16(24)12-5-4-11(8-13(12)17(22)25)15(23)19-18-21-20-14(27-18)9-26-3/h4-5,8,10H,6-7,9H2,1-3H3,(H,19,21,23)InChIKey
QDLQOWLHEKPIRJ-UHFFFAOYSA-NSynonyms
1144490-66-31144490663
CC(C)CCN1C(=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)CCC(C)C)s1
InChI=1SC18H20N4O4Sc110(2)672216(24)125411(813(12)17(22)25)15(23)1918212014(2718)9263h45810H679H213H3(H192123)
MFCD18166927
N((2E)5(methoxymethyl)134thiadiazol2(3H)ylidene)2(3methylbutyl)13dioxo23dihydro1Hisoindole5carboxamide
N(5(methoxymethyl)134thiadiazol2yl)2(3methylbutyl)13dioxoisoindole5carboxamide
ZINC000031809499
ZINC31809499
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