Vitas-M small molecule compound

cyclooctyl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK363892
SMILES O=C1NC(=C(C(N1)c1ccc(cc1)Cl)C(=O)OC1CCCCCCC1)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 C20H25ClN2O3 MW 376.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN2O3/c1-13-17(19(24)26-16-7-5-3-2-4-6-8-16)18(23-20(25)22-13)14-9-11-15(21)12-10-14/h9-12,16,18H,2-8H2,1H3,(H2,22,23,25)
InChIKey
ISMYAFNGYSXEIB-UHFFFAOYSA-N
Synonyms

CC1=C(C(NC(=O)N1)C2=CC=C(C=C2)Cl)C(=O)OC3CCCCCCC3
cyclooctyl4(4chlorophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOOCTYL4(4CHLOROPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CYCLOOCTYL6(4CHLOROPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC20H25ClN2O3c11317(19(24)2616753246816)18(2320(25)2213)1491115(21)121014h9121618H28H21H3(H2222325)
MFCD00365568
ZINC000000823518
ZINC000000823519

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Available files

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