Vitas-M small molecule compound
4-[4-(4-fluorobenzyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STK570871
SMILES CC(c1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)Cc2ccc(cc2)F)/s1)C
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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 C20H26FN5O2S MW 419.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26FN5O2S/c1-14(2)19-23-24-20(29-19)22-17(27)7-8-18(28)26-11-9-25(10-12-26)13-15-3-5-16(21)6-4-15/h3-6,14H,7-13H2,1-2H3,(H,22,24,27)InChIKey
PYDMGYRZZQLABI-UHFFFAOYSA-NSynonyms
714239-77-74(4((4FLUOROPHENYL)METHYL)PIPERAZIN1YL)4OXON(5PROPAN2YL134THIADIAZOL2YL)BUTANAMIDE
4(4(4fluorobenzyl)piperazin1yl)4oxoN((2Z)5(propan2yl)134thiadiazol2(3H)ylidene)butanamide
714239777
CC(C)C1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)F
CC(c1n(nH)c(=NC(=O)CCC(=O)N2CCN(CC2)Cc2ccc(cc2)F)s1)C
InChI=1SC20H26FN5O2Sc114(2)19232420(2919)2217(27)7818(28)2611925(101226)13153516(21)6415h3614H713H212H3(H222427)
MFCD05729439
ZINC000020439195
ZINC20439195
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