Vitas-M small molecule compound
7-bromo-N-[5-(4-ethylbenzyl)-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide
Catalog ID
STL018124
SMILES CCc1ccc(cc1)Cc1cnc(s1)NC(=O)C1=Cc2cc(Br)ccc2OC=C1
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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 C23H19BrN2O2S MW 467.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN2O2S/c1-2-15-3-5-16(6-4-15)11-20-14-25-23(29-20)26-22(27)17-9-10-28-21-8-7-19(24)13-18(21)12-17/h3-10,12-14H,2,11H2,1H3,(H,25,26,27)InChIKey
VYOJBDNAJRIXBP-UHFFFAOYSA-NSynonyms
(7BROMOBENZO(B)OXEPIN4YL)N(5((4ETHYLPHENYL)METHYL)(13THIAZOL2YL))CARBOXAMIDE
7bromoN(5((4ethylphenyl)methyl)13thiazol2yl)1benzoxepine4carboxamide
7bromoN(5(4ethylbenzyl)13thiazol2yl)1benzoxepine4carboxamide
CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC=C3
InChI=1SC23H19BrN2O2Sc12153516(6415)1120142523(2920)2622(27)1791028218719(24)1318(21)1217h3101214H211H21H3(H252627)
MFCD10082149
ZINC000012274586
ZINC12274586
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