Vitas-M small molecule compound
3,9,12-tris(2-methoxyphenyl)-6-thioxo-3,4,9,10-tetrahydro-2H-7,11-methano[1,3,5]triazino[1,2-a][1,5]diazocine-7,11(6H,8H)-dicarbonitrile
Catalog ID
STK886604
SMILES COc1ccccc1N1CN=C2N(C1)C(=S)C1(C(C2(C#N)CN(C1)c1ccccc1OC)c1ccccc1OC)C#N
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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 C32H30N6O3S MW 578.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N6O3S/c1-39-25-13-7-4-10-22(25)28-31(16-33)18-36(23-11-5-8-14-26(23)40-2)19-32(28,17-34)30(42)38-21-37(20-35-29(31)38)24-12-6-9-15-27(24)41-3/h4-15,28H,18-21H2,1-3H3InChIKey
HTUWIBDKDVNNHQ-UHFFFAOYSA-NSynonyms
3912tris(2methoxyphenyl)6thioxo34910tetrahydro2H711methano(135)triazino(12a)(15)diazocine711(6H8H)dicarbonitrile
COC1=CC=CC=C1C2C3(CN(CC2(C(=S)N4C3=NCN(C4)C5=CC=CC=C5OC)C#N)C6=CC=CC=C6OC)C#N
InChI=1SC32H30N6O3Sc1392513741022(25)2831(1633)1836(2311581426(23)402)1932(281734)30(42)382137(203529(31)38)2412691527(24)413h41528H1821H213H3
MFCD10087186
ZINC000103519065
ZINC000226624197
Check stock
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