Vitas-M small molecule compound
2,2'-{benzene-1,4-diylbis[(2-oxoethane-2,1-diyl)sulfanediyl]}bis[6-(2-methylpropyl)pyridine-3-carbonitrile]
Catalog ID
STK523035
SMILES CC(Cc1ccc(c(n1)SCC(=O)c1ccc(cc1)C(=O)CSc1nc(CC(C)C)ccc1C#N)C#N)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 C30H30N4O2S2 MW 542.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N4O2S2/c1-19(2)13-25-11-9-23(15-31)29(33-25)37-17-27(35)21-5-7-22(8-6-21)28(36)18-38-30-24(16-32)10-12-26(34-30)14-20(3)4/h5-12,19-20H,13-14,17-18H2,1-4H3InChIKey
YQPQLQSXGXWKFC-UHFFFAOYSA-NSynonyms
2(2(4(2(3CYANO6(2METHYLPROPYL)PYRIDIN2YL)SULFANYLACETYL)PHENYL)2OXOETHYL)SULFANYL6(2METHYLPROPYL)PYRIDINE3CARBONITRILE
22(benzene14diylbis((2oxoethane21diyl)sulfanediyl))bis(6(2methylpropyl)pyridine3carbonitrile)
CC(C)CC1=NC(=C(C=C1)C#N)SCC(=O)C2=CC=C(C=C2)C(=O)CSC3=C(C=CC(=N3)CC(C)C)C#N
InChI=1SC30H30N4O2S2c119(2)132511923(1531)29(3325)371727(35)215722(8621)28(36)18383024(1632)101226(3430)1420(3)4h5121920H13141718H214H3
MFCD01027403
ZINC000006076985
ZINC6076985
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