Vitas-M small molecule compound
5-(6-chloro-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-6-hydroxy-1-methyl-2-(methylsulfanyl)pyrimidin-4(1H)-one
Catalog ID
STK610673
SMILES CSc1nc(=O)c(c(n1C)O)C1NCCc2c1[nH]c1c2cc(cc1)Cl
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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 C17H17ClN4O2S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2S/c1-22-16(24)12(15(23)21-17(22)25-2)14-13-9(5-6-19-14)10-7-8(18)3-4-11(10)20-13/h3-4,7,14,19-20,24H,5-6H2,1-2H3InChIKey
MGZIZKHUNYFCNQ-UHFFFAOYSA-NSynonyms
5(6chloro2349tetrahydro1Hbetacarbolin1yl)6hydroxy1methyl2(methylsulfanyl)pyrimidin4(1H)one
5(6chloro2349tetrahydro1Hpyrido(34b)indol1yl)6hydroxy1methyl2methylsulfanylpyrimidin4one
CN1C(=C(C(=O)N=C1SC)C2C3=C(CCN2)C4=C(N3)C=CC(=C4)Cl)O
CSc1nc(=O)c(c(n1C)O)C1NCCc2c1(nH)c1c2cc(cc1)Cl
InChI=1SC17H17ClN4O2Sc12216(24)12(15(23)2117(22)252)14139(561914)1078(18)3411(10)2013h34714192024H56H212H3
MFCD18158653
ZINC000102707383
ZINC000102707385
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