Vitas-M small molecule compound
methyl 4-{5-[(4-methylphenyl)carbamoyl]-6-phenyl-2-sulfanyl-3,4-dihydropyrimidin-4-yl}benzoate
Catalog ID
STK115449
SMILES COC(=O)c1ccc(cc1)C1NC(=NC(=C1C(=O)Nc1ccc(cc1)C)c1ccccc1)S
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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 C26H23N3O3S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O3S/c1-16-8-14-20(15-9-16)27-24(30)21-22(17-6-4-3-5-7-17)28-26(33)29-23(21)18-10-12-19(13-11-18)25(31)32-2/h3-15,23H,1-2H3,(H,27,30)(H2,28,29,33)InChIKey
BSKJXXDYSOEPLY-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)NC(=O)C2=C(NC(=S)NC2C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4
InChI=1SC26H23N3O3Sc11681420(15916)2724(30)2122(176435717)2826(33)2923(21)18101219(131118)25(31)322h31523H12H3(H2730)(H2282933)
METHYL4(5((4METHYLPHENYL)CARBAMOYL)6PHENYL2SULFANYL34DIHYDROPYRIMIDIN4YL)BENZOATE
METHYL4(5((4METHYLPHENYL)CARBAMOYL)6PHENYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDIN4YL)BENZOATE
MFCD03996123
ZINC000018093674
ZINC000018093675
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