Vitas-M small molecule compound
4-{3-[(4-chlorobenzyl)oxy]phenyl}-N-(2,4-dimethylphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL426983
SMILES S=C1NC(=C(C(N1)c1cccc(c1)OCc1ccc(cc1)Cl)C(=O)Nc1ccc(cc1C)C)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 C27H26ClN3O2S MW 492.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O2S/c1-16-7-12-23(17(2)13-16)30-26(32)24-18(3)29-27(34)31-25(24)20-5-4-6-22(14-20)33-15-19-8-10-21(28)11-9-19/h4-14,25H,15H2,1-3H3,(H,30,32)(H2,29,31,34)InChIKey
YTVVYEWBLRIMTF-UHFFFAOYSA-NSynonyms
4(3((4chlorobenzyl)oxy)phenyl)N(24dimethylphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
4(3((4CHLOROPHENYL)METHOXY)PHENYL)N(24DIMETHYLPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
CC1=CC(=C(C=C1)NC(=O)C2=C(NC(=S)NC2C3=CC(=CC=C3)OCC4=CC=C(C=C4)Cl)C)C
InChI=1SC27H26ClN3O2Sc11671223(17(2)1316)3026(32)2418(3)2927(34)3125(24)2054622(1420)33151981021(28)11919h41425H15H213H3(H3032)(H2293134)
MFCD06001837
ZINC000016393696
ZINC000016393699
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