Vitas-M small molecule compound
N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-6,7-dimethoxy-1-methyl-1,4-dihydroindeno[1,2-c]pyrazole-3-carboxamide
Catalog ID
STK652700
SMILES COc1cc2c(cc1OC)Cc1c2n(C)nc1C(=O)/N=c\1/sc2c([nH]1)cccc2
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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 C21H18N4O3S MW 406.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S/c1-25-19-12-10-16(28-3)15(27-2)9-11(12)8-13(19)18(24-25)20(26)23-21-22-14-6-4-5-7-17(14)29-21/h4-7,9-10H,8H2,1-3H3,(H,22,23,26)InChIKey
XRSSOMMSEUCCLD-UHFFFAOYSA-NSynonyms
1144470-06-31144470063
CN1C2=C(CC3=CC(=C(C=C32)OC)OC)C(=N1)C(=O)NC4=NC5=CC=CC=C5S4
COc1cc2c(cc1OC)Cc1c2n(C)nc1C(=O)N=c1sc2c((nH)1)cccc2
InChI=1SC21H18N4O3Sc12519121016(283)15(272)911(12)813(19)18(2425)20(26)23212214645717(14)2921h47910H8H213H3(H222326)
MFCD18166415
N((2E)13benzothiazol2(3H)ylidene)67dimethoxy1methyl14dihydroindeno(12c)pyrazole3carboxamide
N(13benzothiazol2yl)67dimethoxy1methyl4Hindeno(12c)pyrazole3carboxamide
ZINC000031816341
ZINC31816341
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