Vitas-M small molecule compound
4-[4-(benzyloxy)phenyl]-N-(2,4-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL426987
SMILES COc1cc(OC)ccc1NC(=O)C1=C(C)NC(=S)NC1c1ccc(cc1)OCc1ccccc1
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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 C27H27N3O4S MW 489.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O4S/c1-17-24(26(31)29-22-14-13-21(32-2)15-23(22)33-3)25(30-27(35)28-17)19-9-11-20(12-10-19)34-16-18-7-5-4-6-8-18/h4-15,25H,16H2,1-3H3,(H,29,31)(H2,28,30,35)InChIKey
ZNUXKFGTNRUAKS-UHFFFAOYSA-NSynonyms
4(4(benzyloxy)phenyl)N(24dimethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)OC)OC
InChI=1SC27H27N3O4Sc11724(26(31)2922141321(322)1523(22)333)25(3027(35)2817)1991120(121019)3416187546818h41525H16H213H3(H2931)(H2283035)
MFCD06003265
N(24DIMETHOXYPHENYL)6METHYL4(4PHENYLMETHOXYPHENYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
ZINC000001049517
ZINC000001049521
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