Vitas-M small molecule compound
4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Catalog ID
STK931141
SMILES O=C(/N=c\1/[nH]nc(s1)C)CCC(=O)N1CCN(CC1)c1nsc2c1cccc2
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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 C18H20N6O2S2 MW 416.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O2S2/c1-12-20-21-18(27-12)19-15(25)6-7-16(26)23-8-10-24(11-9-23)17-13-4-2-3-5-14(13)28-22-17/h2-5H,6-11H2,1H3,(H,19,21,25)InChIKey
HVKGNLBBJAOIAJ-UHFFFAOYSA-NSynonyms
1190270-03-11190270031
4(4(12benzothiazol3yl)piperazin1yl)N((2Z)5methyl134thiadiazol2(3H)ylidene)4oxobutanamide
4(4(12benzothiazol3yl)piperazin1yl)N(5methyl134thiadiazol2yl)4oxobutanamide
CC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=NSC4=CC=CC=C43
InChI=1SC18H20N6O2S2c112202118(2712)1915(25)6716(26)2381024(11923)1713423514(13)282217h25H611H21H3(H192125)
MFCD18176849
O=C(N=c1(nH)nc(s1)C)CCC(=O)N1CCN(CC1)c1nsc2c1cccc2
ZINC000036355059
ZINC36355059
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