Vitas-M small molecule compound
1-{3-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]propyl}-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK079929
SMILES CCCn1c2ccccc2c2c1nc(SCCCn1c(=O)[nH]c3c1cccc3)nn2
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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 C22H22N6OS MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6OS/c1-2-12-27-17-10-5-3-8-15(17)19-20(27)24-21(26-25-19)30-14-7-13-28-18-11-6-4-9-16(18)23-22(28)29/h3-6,8-11H,2,7,12-14H2,1H3,(H,23,29)InChIKey
FAFMGCUBSVOGPE-UHFFFAOYSA-NSynonyms
1(3((5PROPYL5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)PROPYL)13DIHYDRO2HBENZIMIDAZOL2ONE
3(3((5PROPYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)PROPYL)1HBENZIMIDAZOL2ONE
CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCCCN4C5=CC=CC=C5NC4=O
CCCn1c2ccccc2c2c1nc(SCCCn1c(=O)(nH)c3c1cccc3)nn2
InChI=1SC22H22N6OSc121227171053815(17)1920(27)2421(262519)301471328181164916(18)2322(28)29h36811H271214H21H3(H2329)
MFCD03197167
STK079929
ZINC000002751170
ZINC02751170
ZINC2751170
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