Vitas-M small molecule compound
cycloheptyl 4-(2,3-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK402350
SMILES COc1c(OC)cccc1C1NC(=O)NC(=C1C(=O)OC1CCCCCC1)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 C21H28N2O5 MW 388.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O5/c1-13-17(20(24)28-14-9-6-4-5-7-10-14)18(23-21(25)22-13)15-11-8-12-16(26-2)19(15)27-3/h8,11-12,14,18H,4-7,9-10H2,1-3H3,(H2,22,23,25)InChIKey
BZDRDCWHMYQGGN-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=C(C(=CC=C2)OC)OC)C(=O)OC3CCCCCC3
cycloheptyl4(23dimethoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOHEPTYL4(23DIMETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CYCLOHEPTYL6(23DIMETHOXYPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC21H28N2O5c11317(20(24)2814964571014)18(2321(25)2213)151181216(262)19(15)273h811121418H47910H213H3(H2222325)
MFCD01192459
ZINC000000844290
ZINC000000844291
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