Vitas-M small molecule compound
4-{4-[(5-bromothiophen-2-yl)sulfonyl]piperazin-1-yl}-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STL054098
SMILES CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)c2ccc(s2)Br)/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 C17H22BrN5O4S3 MW 536.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22BrN5O4S3/c1-2-3-14-20-21-17(29-14)19-13(24)5-6-15(25)22-8-10-23(11-9-22)30(26,27)16-7-4-12(18)28-16/h4,7H,2-3,5-6,8-11H2,1H3,(H,19,21,24)InChIKey
NYZRSPZLABAXJJ-UHFFFAOYSA-NSynonyms
714937-45-84(4((5bromothiophen2yl)sulfonyl)piperazin1yl)4oxoN((2Z)5propyl134thiadiazol2(3H)ylidene)butanamide
4(4(5BROMOTHIOPHEN2YL)SULFONYLPIPERAZIN1YL)4OXON(5PROPYL134THIADIAZOL2YL)BUTANAMIDE
714937458
CCCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br
CCCc1n(nH)c(=NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)c2ccc(s2)Br)s1
InChI=1SC17H22BrN5O4S3c12314202117(2914)1913(24)5615(25)2281023(11922)30(2627)167412(18)2816h47H2356811H21H3(H192124)
MFCD05736393
ZINC000002588276
ZINC2588276
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