Vitas-M small molecule compound
1-(benzyl{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-1-hydroxyethyl}amino)-N-[4-(dimethylamino)phenyl]cyclohexanecarboxamide
Catalog ID
STL438840
SMILES Cc1nc(SCC(N(C2(CCCCC2)C(=O)Nc2ccc(cc2)N(C)C)Cc2ccccc2)O)nc(c1)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 C30H39N5O2S MW 533.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H39N5O2S/c1-22-19-23(2)32-29(31-22)38-21-27(36)35(20-24-11-7-5-8-12-24)30(17-9-6-10-18-30)28(37)33-25-13-15-26(16-14-25)34(3)4/h5,7-8,11-16,19,27,36H,6,9-10,17-18,20-21H2,1-4H3,(H,33,37)InChIKey
LMLHIXBHENYARC-UHFFFAOYSA-NSynonyms
1(benzyl(2((46dimethylpyrimidin2yl)sulfanyl)1hydroxyethyl)amino)N(4(dimethylamino)phenyl)cyclohexanecarboxamide
1(benzyl(2(46dimethylpyrimidin2yl)sulfanyl1hydroxyethyl)amino)N(4(dimethylamino)phenyl)cyclohexane1carboxamide
1(BENZYL(2(46DIMETHYLPYRIMIDIN2YL)SULFANYL1HYDROXYETHYL)AMINO)N(4DIMETHYLAMINOPHENYL)CYCLOHEXANE1CARBOXAMIDE
1(BENZYL(2(46DIMETHYLPYRIMIDIN2YLTHIO)1HYDROXYETHYL)AMINO)N(4(DIMETHYLAMINO)PHENYL)CYCLOHEXANECARBOXAMIDE
CC1=CC(=NC(=N1)SCC(N(CC2=CC=CC=C2)C3(CCCCC3)C(=O)NC4=CC=C(C=C4)N(C)C)O)C
InChI=1SC30H39N5O2Sc1221923(2)3229(3122)382127(36)35(2024117581224)30(1796101830)28(37)3325131526(161425)34(3)4h5781116192736H691017182021H214H3(H3337)
MFCD06243898
ZINC000008695697
ZINC000008695698
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