Vitas-M small molecule compound
3-(1,3-dimethyl-2,4,6-trioxo-2,3,4,5,6,11-hexahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-5-yl)phenyl 4-methylbenzoate
Catalog ID
STK138275
SMILES Cc1ccc(cc1)C(=O)Oc1cccc(c1)C1C2=C(Nc3c1c(=O)n(c(=O)n3C)C)c1c(C2=O)cccc1
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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 C30H23N3O5 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O5/c1-16-11-13-17(14-12-16)29(36)38-19-8-6-7-18(15-19)22-23-25(20-9-4-5-10-21(20)26(23)34)31-27-24(22)28(35)33(3)30(37)32(27)2/h4-15,22,31H,1-3H3InChIKey
TXJBEAFMZKLGJI-UHFFFAOYSA-NSynonyms
3(13dimethyl246trioxo2345611hexahydro1Hindeno(2156)pyrido(23d)pyrimidin5yl)phenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C3C4=C(C5=CC=CC=C5C4=O)NC6=C3C(=O)N(C(=O)N6C)C
InChI=1SC30H23N3O5c116111317(141216)29(36)381986718(1519)222325(209451021(20)26(23)34)312724(22)28(35)33(3)30(37)32(27)2h4152231H13H3
MFCD01949152
ZINC000001218546
ZINC000001218547
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