Vitas-M small molecule compound
1,3-bis(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)propan-2-one
Catalog ID
STK751387
SMILES O=C(CSc1nnc2c(n1)[nH]c1c2cccc1)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 C21H14N8OS2 MW 458.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N8OS2/c30-11(9-31-20-24-18-16(26-28-20)12-5-1-3-7-14(12)22-18)10-32-21-25-19-17(27-29-21)13-6-2-4-8-15(13)23-19/h1-8H,9-10H2,(H,22,24,28)(H,23,25,29)InChIKey
FBHAFGICZWIOJG-UHFFFAOYSA-NSynonyms
13bis(5H(124)triazino(56b)indol3ylsulfanyl)propan2one
13DI(124TRIAZINO(56B)INDOL3YLTHIO)ACETONE
C1=CC=C2C(=C1)C3=C(N2)N=C(N=N3)SCC(=O)CSC4=NC5=C(C6=CC=CC=C6N5)N=N4
InChI=1SC21H14N8OS2c3011(93120241816(262820)12513714(12)2218)103221251917(272921)13624815(13)2319h18H910H2(H222428)(H232529)
MFCD00746975
O=C(CSc1nnc2c(n1)(nH)c1c2cccc1)CSc1nnc2c(n1)(nH)c1c2cccc1
ZINC000002176624
ZINC02176624
ZINC2176624
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