Vitas-M small molecule compound
(2S)-3-phenyl-2-(1H-tetrazol-1-yl)-N-[(2Z)-6-(trifluoromethoxy)-1,3-benzothiazol-2(3H)-ylidene]propanamide
Catalog ID
STK652286
SMILES O=C([C@@H](n1cnnn1)Cc1ccccc1)/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 C18H13F3N6O2S MW 434.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13F3N6O2S/c19-18(20,21)29-12-6-7-13-15(9-12)30-17(23-13)24-16(28)14(27-10-22-25-26-27)8-11-4-2-1-3-5-11/h1-7,9-10,14H,8H2,(H,23,24,28)/t14-/m0/s1InChIKey
XSNDQEMGTHFQRG-AWEZNQCLSA-NSynonyms
1212297-27-2(2S)3phenyl2(1Htetrazol1yl)N((2Z)6(trifluoromethoxy)13benzothiazol2(3H)ylidene)propanamide
(2S)3phenyl2(tetrazol1yl)N(6(trifluoromethoxy)13benzothiazol2yl)propanamide
1212297272
C1=CC=C(C=C1)CC(C(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)(F)F)N4C=NN=N4
InChI=1SC18H13F3N6O2Sc1918(2021)2912671315(912)3017(2313)2416(28)14(271022252627)8114213511h1791014H8H2(H232428)t14m0s1
MFCD18166279
O=C((C@@H)(n1cnnn1)Cc1ccccc1)N=c1sc2c((nH)1)ccc(c2)OC(F)(F)F
ZINC000036357465
ZINC36357465
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