Vitas-M small molecule compound
7-[(4-bromobenzyl)sulfanyl]-9-(methylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STL227043
SMILES CSc1nc(SCc2ccc(cc2)Br)c2c(n1)c1c(s2)nc(c2c1CCC2)C(C)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 C23H22BrN3S3 MW 516.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3S3/c1-12(2)18-16-6-4-5-15(16)17-19-20(30-21(17)25-18)22(27-23(26-19)28-3)29-11-13-7-9-14(24)10-8-13/h7-10,12H,4-6,11H2,1-3H3InChIKey
AUJLQBGJYGBVME-UHFFFAOYSA-NSynonyms
799833-85-57((4bromobenzyl)sulfanyl)9(methylsulfanyl)4(propan2yl)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
7((4bromobenzyl)thio)4isopropyl9(methylthio)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
799833855
CC(C)C1=C2CCCC2=C3C4=C(C(=NC(=N4)SC)SCC5=CC=C(C=C5)Br)SC3=N1
InChI=1SC23H22BrN3S3c112(2)181664515(16)171920(3021(17)2518)22(2723(2619)283)2911137914(24)10813h71012H4611H213H3
MFCD03684865
ZINC000002246515
ZINC02246515
ZINC2246515
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