Vitas-M small molecule compound
4-oxo-4-(3-oxopiperazin-1-yl)-N-[(2Z)-6-(trifluoromethoxy)-1,3-benzothiazol-2(3H)-ylidene]butanamide
Catalog ID
STK928340
SMILES O=C1NCCN(C1)C(=O)CCC(=O)/N=c/1\sc2c([nH]1)ccc(c2)OC(F)(F)F
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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 C16H15F3N4O4S MW 416.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15F3N4O4S/c17-16(18,19)27-9-1-2-10-11(7-9)28-15(21-10)22-12(24)3-4-14(26)23-6-5-20-13(25)8-23/h1-2,7H,3-6,8H2,(H,20,25)(H,21,22,24)InChIKey
QQZWIBUYMJZGJQ-UHFFFAOYSA-NSynonyms
1219557-93-31219557933
4oxo4(3oxopiperazin1yl)N((2Z)6(trifluoromethoxy)13benzothiazol2(3H)ylidene)butanamide
C1CN(CC(=O)N1)C(=O)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)(F)F
InChI=1SC16H15F3N4O4Sc1716(1819)279121011(79)2815(2110)2212(24)3414(26)23652013(25)823h127H368H2(H2025)(H212224)
MFCD18176070
O=C1NCCN(C1)C(=O)CCC(=O)N=c1sc2c((nH)1)ccc(c2)OC(F)(F)F
ZINC000040266467
ZINC40266467
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