Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-2-(ethylsulfonyl)-5-[(4-fluorobenzyl)(furan-2-ylmethyl)amino]pyrimidine-4-carboxamide
Catalog ID
STK820597
SMILES CCS(=O)(=O)c1ncc(c(n1)C(=O)Nc1ccc(c(c1)C)C)N(Cc1ccco1)Cc1ccc(cc1)F
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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 C27H27FN4O4S MW 522.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN4O4S/c1-4-37(34,35)27-29-15-24(25(31-27)26(33)30-22-12-7-18(2)19(3)14-22)32(17-23-6-5-13-36-23)16-20-8-10-21(28)11-9-20/h5-15H,4,16-17H2,1-3H3,(H,30,33)InChIKey
CMEPRUZQALWYEY-UHFFFAOYSA-NSynonyms
CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC(=C(C=C2)C)C)N(CC3=CC=C(C=C3)F)CC4=CC=CO4
InChI=1SC27H27FN4O4Sc1437(3435)27291524(25(3127)26(33)302212718(2)19(3)1422)32(172365133623)162081021(28)11920h515H41617H213H3(H3033)
MFCD08549970
N(34DIMETHYLPHENYL)(2(ETHYLSULFONYL)5(((4FLUOROPHENYL)METHYL)(2FURYLMETHYL)AMINO)PYRIMIDIN4YL)CARBOXAMIDE
N(34dimethylphenyl)2(ethylsulfonyl)5((4fluorobenzyl)(furan2ylmethyl)amino)pyrimidine4carboxamide
N(34dimethylphenyl)2ethylsulfonyl5((4fluorophenyl)methyl(furan2ylmethyl)amino)pyrimidine4carboxamide
ZINC000009250644
ZINC09250644
ZINC9250644
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