Vitas-M small molecule compound
N-[(2Z)-5-(4-methoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
Catalog ID
STK938469
SMILES COc1ccc(cc1)Cc1n[nH]/c(=N/C(=O)CCCn2sc3c(c2=O)cccc3)/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 C21H20N4O3S2 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S2/c1-28-15-10-8-14(9-11-15)13-19-23-24-21(29-19)22-18(26)7-4-12-25-20(27)16-5-2-3-6-17(16)30-25/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,22,24,26)InChIKey
HFIJJPPMURCAQU-UHFFFAOYSA-NSynonyms
1190275-46-71190275467
COC1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)CCCN3C(=O)C4=CC=CC=C4S3
COc1ccc(cc1)Cc1n(nH)c(=NC(=O)CCCn2sc3c(c2=O)cccc3)s1
InChI=1SC21H20N4O3S2c1281510814(91115)1319232421(2919)2218(26)74122520(27)16523617(16)3025h2356811H471213H21H3(H222426)
MFCD18178963
N((2Z)5(4methoxybenzyl)134thiadiazol2(3H)ylidene)4(3oxo12benzothiazol2(3H)yl)butanamide
N(5((4methoxyphenyl)methyl)134thiadiazol2yl)4(3oxo12benzothiazol2yl)butanamide
ZINC000036353898
ZINC36353898
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