Vitas-M small molecule compound
2-amino-4-(4-bromophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbothioamide
Catalog ID
STL323484
SMILES Brc1ccc(cc1)C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C(=S)N
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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 C18H19BrN2O2S MW 407.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrN2O2S/c1-18(2)7-11(22)14-12(8-18)23-16(20)15(17(21)24)13(14)9-3-5-10(19)6-4-9/h3-6,13H,7-8,20H2,1-2H3,(H2,21,24)InChIKey
HSNSPYAXXXDITF-UHFFFAOYSA-NSynonyms
117822-66-9117822669
2amino4(4bromophenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbothioamide
2AMINO4(4BROMOPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOTHIOAMIDE
CC1(CC2=C(C(C(=C(O2)N)C(=S)N)C3=CC=C(C=C3)Br)C(=O)C1)C
InChI=1SC18H19BrN2O2Sc118(2)711(22)1412(818)2316(20)15(17(21)24)13(14)93510(19)649h3613H7820H212H3(H22124)
MFCD01085419
ZINC000002259032
ZINC000002259033
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