Vitas-M small molecule compound
(2E)-2-{(2E)-[1-(4-bromophenyl)ethylidene]hydrazinylidene}-N-[4-(hexyloxy)phenyl]-4-oxo-1,3-thiazinane-6-carboxamide
Catalog ID
STK049032
SMILES CCCCCCOc1ccc(cc1)NC(=O)C1CC(=O)N/C(=N\N=C(\c2ccc(cc2)Br)/C)/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 C25H29BrN4O3S MW 545.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29BrN4O3S/c1-3-4-5-6-15-33-21-13-11-20(12-14-21)27-24(32)22-16-23(31)28-25(34-22)30-29-17(2)18-7-9-19(26)10-8-18/h7-14,22H,3-6,15-16H2,1-2H3,(H,27,32)(H,28,30,31)/b29-17+InChIKey
LMRLUQGFLAATCY-STBIYBPSSA-NSynonyms
(2E)2((2E)(1(4BROMOPHENYL)ETHYLIDENE)HYDRAZINYLIDENE)N(4(HEXYLOXY)PHENYL)4OXO13THIAZINANE6CARBOXAMIDE
2((2E)2(1(4bromophenyl)ethylidene)hydrazinyl)N(4hexoxyphenyl)4oxo56dihydro13thiazine6carboxamide
CCCCCCOC1=CC=C(C=C1)NC(=O)C2CC(=O)N=C(S2)NN=C(C)C3=CC=C(C=C3)Br
CCCCCCOc1ccc(cc1)NC(=O)C1CC(=O)NC(=NN=C(c2ccc(cc2)Br)C)S1
InChI=1SC25H29BrN4O3Sc13456153321131120(121421)2724(32)221623(31)2825(3422)302917(2)187919(26)10818h71422H361516H212H3(H2732)(H283031)b2917+
MFCD03057503
STK049032
ZINC000097958645
ZINC000097958646
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