Vitas-M small molecule compound
1-(3-acetyl-1',3'-dimethyl-2',4',6'-trioxo-1',2,3,3',4,4',4a,6'-octahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)-3-phenylurea
Catalog ID
STK575160
SMILES O=C(Nc1ccccc1)Nc1ccc2c(c1)CC1(C3N2CCN(C3)C(=O)C)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 C26H28N6O5 MW 504.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O5/c1-16(33)31-11-12-32-20-10-9-19(28-24(36)27-18-7-5-4-6-8-18)13-17(20)14-26(21(32)15-31)22(34)29(2)25(37)30(3)23(26)35/h4-10,13,21H,11-12,14-15H2,1-3H3,(H2,27,28,36)InChIKey
KQRPKCBSIUQEHF-UHFFFAOYSA-NSynonyms
902013-44-91(3acetyl13dimethyl246trioxo1223344a466decahydro1Hspiro(pyrazino(12a)quinoline55pyrimidin)8yl)3phenylurea
1(3acetyl13dimethyl246trioxo1233444a6octahydro1H2H6Hspiro(pyrazino(12a)quinoline55pyrimidin)8yl)3phenylurea
1(3acetyl13dimethyl246trioxospiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)8yl)3phenylurea
902013449
CC(=O)N1CCN2C(C1)C3(CC4=C2C=CC(=C4)NC(=O)NC5=CC=CC=C5)C(=O)N(C(=O)N(C3=O)C)C
InChI=1SC26H28N6O5c116(33)311112322010919(2824(36)27187546818)1317(20)1426(21(32)1531)22(34)29(2)25(37)30(3)23(26)35h4101321H11121415H213H3(H2272836)
MFCD06784353
ZINC000009215970
ZINC000009215972
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