Vitas-M small molecule compound
6-amino-2-[(4-cyanobenzyl)sulfanyl]pyrimidin-4-yl 4-methylbenzenesulfonate
Catalog ID
STL347179
SMILES N#Cc1ccc(cc1)CSc1nc(cc(n1)N)OS(=O)(=O)c1ccc(cc1)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 C19H16N4O3S2 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4O3S2/c1-13-2-8-16(9-3-13)28(24,25)26-18-10-17(21)22-19(23-18)27-12-15-6-4-14(11-20)5-7-15/h2-10H,12H2,1H3,(H2,21,22,23)InChIKey
HWEJGHMXMGRFOB-UHFFFAOYSA-NSynonyms
849020-48-0(6AMINO2((4CYANOPHENYL)METHYLSULFANYL)PYRIMIDIN4YL)4METHYLBENZENESULFONATE
6amino2((4cyanobenzyl)sulfanyl)pyrimidin4yl4methylbenzenesulfonate
6amino2((4cyanobenzyl)thio)pyrimidin4yl4methylbenzenesulfonate
849020480
CC1=CC=C(C=C1)S(=O)(=O)OC2=NC(=NC(=C2)N)SCC3=CC=C(C=C3)C#N
InChI=1SC19H16N4O3S2c1132816(9313)28(2425)26181017(21)2219(2318)2712156414(1120)5715h210H12H21H3(H2212223)
MFCD05681168
ZINC000002453019
ZINC02453019
ZINC2453019
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