Vitas-M small molecule compound
3-{[(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole
Catalog ID
STK680889
SMILES CC1(C)Cc2ccccc2C(=N1)CSc1nnc2c(n1)[nH]c1c2cccc1
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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 C21H19N5S MW 373.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5S/c1-21(2)11-13-7-3-4-8-14(13)17(24-21)12-27-20-23-19-18(25-26-20)15-9-5-6-10-16(15)22-19/h3-10H,11-12H2,1-2H3,(H,22,23,26)InChIKey
IPZLWMCLGBNNOP-UHFFFAOYSA-NSynonyms
3(((33dimethyl34dihydroisoquinolin1yl)methyl)sulfanyl)5H(124)triazino(56b)indole
3((33DIMETHYL4HISOQUINOLIN1YL)METHYLSULFANYL)5H(124)TRIAZINO(56B)INDOLE
CC1(C)Cc2ccccc2C(=N1)CSc1nnc2c(n1)(nH)c1c2cccc1
CC1(CC2=CC=CC=C2C(=N1)CSC3=NC4=C(C5=CC=CC=C5N4)N=N3)C
InChI=1SC21H19N5Sc121(2)1113734814(13)17(2421)122720231918(252620)159561016(15)2219h310H1112H212H3(H222326)
MFCD03767679
ZINC000002504002
ZINC02504002
ZINC2504002
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