Vitas-M small molecule compound
(4-{[(2E)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}phenyl)[4-(methylsulfonyl)piperazin-1-yl]methanone
Catalog ID
STL314082
SMILES Cc1cc(C)[nH]/c(=N\c2ccc(cc2)C(=O)N2CCN(CC2)S(=O)(=O)C)/n1
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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 C18H23N5O3S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O3S/c1-13-12-14(2)20-18(19-13)21-16-6-4-15(5-7-16)17(24)22-8-10-23(11-9-22)27(3,25)26/h4-7,12H,8-11H2,1-3H3,(H,19,20,21)InChIKey
MDOFFWIPUYAOKQ-UHFFFAOYSA-NSynonyms
1435981-54-6(4(((2E)46dimethylpyrimidin2(1H)ylidene)amino)phenyl)(4(methylsulfonyl)piperazin1yl)methanone
(4((46dimethylpyrimidin2yl)amino)phenyl)(4methylsulfonylpiperazin1yl)methanone
1435981546
CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C)C
Cc1cc(C)(nH)c(=Nc2ccc(cc2)C(=O)N2CCN(CC2)S(=O)(=O)C)n1
InChI=1SC18H23N5O3Sc1131214(2)2018(1913)21166415(5716)17(24)2281023(11922)27(325)26h4712H811H213H3(H192021)
MFCD28030490
ZINC000095476077
ZINC95476077
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