Vitas-M small molecule compound
7-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-N-(2,4-dimethylphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK199546
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1ccc(cc1C)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 C29H28ClN5O3 MW 530.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClN5O3/c1-17-5-11-23(18(2)13-17)34-28(36)26-19(3)33-29-31-16-32-35(29)27(26)21-8-12-24(25(14-21)37-4)38-15-20-6-9-22(30)10-7-20/h5-14,16,27H,15H2,1-4H3,(H,34,36)(H,31,32,33)InChIKey
RLBWPTSQYLXUKB-UHFFFAOYSA-NSynonyms
7(4((4CHLOROBENZYL)OXY)3METHOXYPHENYL)N(24DIMETHYLPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(4((4chlorophenyl)methoxy)3methoxyphenyl)N(24dimethylphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CC1=CC(=C(C=C1)NC(=O)C2=C(N=C3N=CNN3C2C4=CC(=C(C=C4)OCC5=CC=C(C=C5)Cl)OC)C)C
InChI=1SC29H28ClN5O3c11751123(18(2)1317)3428(36)2619(3)332931163235(29)27(26)2181224(25(1421)374)3815206922(30)10720h5141627H15H214H3(H3436)(H313233)
MFCD06092832
ZINC000098043454
ZINC000098043455
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