Vitas-M small molecule compound
1-(1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)-3-methylthiourea
Catalog ID
STK583735
SMILES CNC(=S)Nc1ccc2c(c1)CC1(C3N2CCCC3)C(=O)N(C)C(=O)N(C1=O)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 C20H25N5O3S MW 415.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O3S/c1-21-18(29)22-13-7-8-14-12(10-13)11-20(15-6-4-5-9-25(14)15)16(26)23(2)19(28)24(3)17(20)27/h7-8,10,15H,4-6,9,11H2,1-3H3,(H2,21,22,29)InChIKey
SDVCVKCWYICNBE-UHFFFAOYSA-NSynonyms
879766-10-61(13dimethyl246trioxo1223344a466decahydro1Hspiro(pyrido(12a)quinoline55pyrimidin)8yl)3methylthiourea
1(13dimethyl246trioxo1233444a6octahydro1H2H6Hspiro(pyrido(12a)quinoline55pyrimidin)8yl)3methylthiourea
1(13dimethyl246trioxospiro(12344a6hexahydrobenzo(c)quinolizine5513diazinane)8yl)3methylthiourea
879766106
CNC(=S)NC1=CC2=C(C=C1)N3CCCCC3C4(C2)C(=O)N(C(=O)N(C4=O)C)C
InChI=1SC20H25N5O3Sc12118(29)2213781412(1013)1120(15645925(14)15)16(26)23(2)19(28)24(3)17(20)27h781015H46911H213H3(H2212229)
MFCD07639886
ZINC000005427256
ZINC000005427271
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