Vitas-M small molecule compound
7'-amino-1-benzyl-2'-(methylsulfanyl)-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Catalog ID
STK781437
SMILES N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)Cc1ccccc1)c(=O)[nH]c(n2)SC
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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 C23H18N6O2S MW 442.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N6O2S/c1-32-22-27-19-17(20(30)28-22)23(15(11-24)18(25)26-19)14-9-5-6-10-16(14)29(21(23)31)12-13-7-3-2-4-8-13/h2-10H,12,25H2,1H3,(H2,26,27,28,30)InChIKey
OSWMRGHXOUQNNC-UHFFFAOYSA-NSynonyms
7amino1benzyl2(methylsulfanyl)24dioxo1248tetrahydro3Hspiro(indole35pyrido(23d)pyrimidine)6carbonitrile
7AMINO1BENZYL2METHYLSULFANYL24DIOXOSPIRO(18DIHYDROPYRIDO(23D)PYRIMIDINE53INDOLE)6CARBONITRILE
7AMINO2METHYLTHIO412DIOXO11BENZYLSPIRO(358TRIHYDROPYRIDINO(23D)PYRIMIDINE53INDOLINE)6CARBONITRILE
CSC1=NC(=O)C2=C(N1)NC(=C(C23C4=CC=CC=C4N(C3=O)CC5=CC=CC=C5)C#N)N
InChI=1SC23H18N6O2Sc13222271917(20(30)2822)23(15(1124)18(25)2619)149561016(14)29(21(23)31)12137324813h210H1225H21H3(H226272830)
MFCD06015050
N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)Cc1ccccc1)c(=O)(nH)c(n2)SC
ZINC000012371873
ZINC000012371874
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