Vitas-M small molecule compound
2,3-dihydro-1,4-benzodioxin-2-yl(4-{[4-(dimethylamino)phenyl]carbonothioyl}piperazin-1-yl)methanone
Catalog ID
STK627380
SMILES O=C(C1COc2c(O1)cccc2)N1CCN(CC1)C(=S)c1ccc(cc1)N(C)C
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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 C22H25N3O3S MW 411.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S/c1-23(2)17-9-7-16(8-10-17)22(29)25-13-11-24(12-14-25)21(26)20-15-27-18-5-3-4-6-19(18)28-20/h3-10,20H,11-15H2,1-2H3InChIKey
OFPRWEPHJFKYFQ-UHFFFAOYSA-NSynonyms
951989-78-9(23dihydrobenzo(b)(14)dioxin2yl)(4(4(dimethylamino)phenylcarbonothioyl)piperazin1yl)methanone
23dihydro14benzodioxin2yl(4((4(dimethylamino)phenyl)carbonothioyl)piperazin1yl)methanone
23dihydro14benzodioxin3yl(4(4(dimethylamino)benzenecarbothioyl)piperazin1yl)methanone
951989789
CN(C)C1=CC=C(C=C1)C(=S)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3
InChI=1SC22H25N3O3Sc123(2)179716(81017)22(29)25131124(121425)21(26)20152718534619(18)2820h31020H1115H212H3
MFCD09858218
ZINC000013733250
ZINC000013733253
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