Vitas-M small molecule compound
7'-amino-2'-[(2-fluorobenzyl)sulfanyl]-2,4'-dioxo-1-(prop-2-en-1-yl)-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Catalog ID
STK781547
SMILES C=CCN1c2ccccc2C2(C1=O)C(=C(N)Nc1c2c(=O)[nH]c(n1)SCc1ccccc1F)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 C25H19FN6O2S MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19FN6O2S/c1-2-11-32-18-10-6-4-8-15(18)25(23(32)34)16(12-27)20(28)29-21-19(25)22(33)31-24(30-21)35-13-14-7-3-5-9-17(14)26/h2-10H,1,11,13,28H2,(H2,29,30,31,33)InChIKey
UKDDRHUUNXIXKU-UHFFFAOYSA-NSynonyms
7amino2((2fluorobenzyl)sulfanyl)24dioxo1(prop2en1yl)1248tetrahydro3Hspiro(indole35pyrido(23d)pyrimidine)6carbonitrile
7AMINO2((2FLUOROPHENYL)METHYLSULFANYL)24DIOXO1PROP2ENYLSPIRO(18DIHYDROPYRIDO(23D)PYRIMIDINE53INDOLE)6CARBONITRILE
C=CCN1C2=CC=CC=C2C3(C1=O)C(=C(NC4=C3C(=O)N=C(N4)SCC5=CC=CC=C5F)N)C#N
C=CCN1c2ccccc2C2(C1=O)C(=C(N)Nc1c2c(=O)(nH)c(n1)SCc1ccccc1F)C#N
InChI=1SC25H19FN6O2Sc121132181064815(18)25(23(32)34)16(1227)20(28)292119(25)22(33)3124(3021)351314735917(14)26h210H1111328H2(H229303133)
MFCD06015271
ZINC000012363558
ZINC000012363559
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