Vitas-M small molecule compound
prop-2-en-1-yl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK841530
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)N
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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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-4-9-26-20(25)17-13(3)23-19(27-11-16(22)24)15(10-21)18(17)14-7-5-12(2)6-8-14/h4-8,18,23H,1,9,11H2,2-3H3,(H2,22,24)InChIKey
BTFMMMYEMRSVRK-UHFFFAOYSA-NSynonyms
442556-34-5442556345
6CARBAMOYLMETHYLSULFANYL5CYANO2METHYL4PTOLYL14DIHYDROPYRIDINE3CARBOXYLICACIDALLYLESTER
ALLYL6((2AMINO2OXOETHYL)THIO)5CYANO2METHYL4(PTOLYL)14DIHYDROPYRIDINE3CARBOXYLATE
CC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OCC=C)C)SCC(=O)N)C#N
InChI=1SC20H21N3O3Sc1492620(25)1713(3)2319(271116(22)24)15(1021)18(17)147512(2)6814h481823H1911H223H3(H22224)
MFCD03292645
prop2en1yl6((2amino2oxoethyl)sulfanyl)5cyano2methyl4(4methylphenyl)14dihydropyridine3carboxylate
PROP2ENYL6(2AMINO2OXOETHYL)SULFANYL5CYANO2METHYL4(4METHYLPHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000020066037
ZINC000100849743
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