Vitas-M small molecule compound
3-(2-amino-4,6-dioxo-4,5,6,11-tetrahydro-3H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl)phenyl benzoate
Catalog ID
STK197304
SMILES Nc1nc2NC3=C(C(c2c(=O)[nH]1)c1cccc(c1)OC(=O)c1ccccc1)C(=O)c1c3cccc1
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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 C27H18N4O4 MW 462.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N4O4/c28-27-30-24-21(25(33)31-27)19(20-22(29-24)17-11-4-5-12-18(17)23(20)32)15-9-6-10-16(13-15)35-26(34)14-7-2-1-3-8-14/h1-13,19H,(H4,28,29,30,31,33)InChIKey
CFEOCXQAWMLBIV-UHFFFAOYSA-NSynonyms
774562-48-03(2amino46dioxo45611tetrahydro3Hindeno(2156)pyrido(23d)pyrimidin5yl)phenylbenzoate
774562480
C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C3C4=C(C5=CC=CC=C5C4=O)NC6=C3C(=O)N=C(N6)N
InChI=1SC27H18N4O4c2827302421(25(33)3127)19(2022(2924)1711451218(17)23(20)32)15961016(1315)3526(34)147213814h11319H(H42829303133)
MFCD06608262
Nc1nc2NC3=C(C(c2c(=O)(nH)1)c1cccc(c1)OC(=O)c1ccccc1)C(=O)c1c3cccc1
ZINC000004650369
ZINC000009934501
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