Vitas-M small molecule compound
N-[(2Z)-4-(pyridin-2-yl)-1,3-thiazol-2(3H)-ylidene]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Catalog ID
STL157491
SMILES O=C(c1ccc2c(c1)OCCCO2)/N=c/1\scc([nH]1)c1ccccn1
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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 C18H15N3O3S MW 353.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O3S/c22-17(12-5-6-15-16(10-12)24-9-3-8-23-15)21-18-20-14(11-25-18)13-4-1-2-7-19-13/h1-2,4-7,10-11H,3,8-9H2,(H,20,21,22)InChIKey
AODKALSMRHBSMF-UHFFFAOYSA-NSynonyms
930933-50-9930933509
C1COC2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=CC=N4)OC1
InChI=1SC18H15N3O3Sc2217(12561516(1012)249382315)21182014(112518)1341271913h12471011H389H2(H202122)
MFCD20758021
N((2Z)4(pyridin2yl)13thiazol2(3H)ylidene)34dihydro2H15benzodioxepine7carboxamide
N(4pyridin2yl13thiazol2yl)34dihydro2H15benzodioxepine7carboxamide
O=C(c1ccc2c(c1)OCCCO2)N=c1scc((nH)1)c1ccccn1
ZINC000009657454
ZINC09657454
ZINC9657454
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