Vitas-M small molecule compound
N-(4-chloro-2,5-dimethoxyphenyl)-7-{3-ethoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185030
SMILES CCOc1cc(ccc1OCc1ccc(cc1)C)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1cc(OC)c(cc1OC)Cl
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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 C31H32ClN5O5 MW 590.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32ClN5O5/c1-6-41-27-13-21(11-12-24(27)42-16-20-9-7-18(2)8-10-20)29-28(19(3)35-31-33-17-34-37(29)31)30(38)36-23-15-25(39-4)22(32)14-26(23)40-5/h7-15,17,29H,6,16H2,1-5H3,(H,36,38)(H,33,34,35)InChIKey
GKVJHWBNFNOFIC-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)NC4=CC(=C(C=C4OC)Cl)OC)OCC5=CC=C(C=C5)C
InChI=1SC31H32ClN5O5c1641271321(111224(27)4216209718(2)81020)2928(19(3)353133173437(29)31)30(38)36231525(394)22(32)1426(23)405h7151729H616H215H3(H3638)(H333435)
MFCD06150949
N(4CHLORO25DIMETHOXYPHENYL)7(3ETHOXY4((4METHYLBENZYL)OXY)PHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
N(4chloro25dimethoxyphenyl)7(3ethoxy4((4methylphenyl)methoxy)phenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000098043513
ZINC000098043514
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