Vitas-M small molecule compound
2-(4-tert-butylphenyl)-1-(4-methoxyphenyl)-4-oxo-6-sulfanyl-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Catalog ID
STK950100
SMILES COc1ccc(cc1)N1C(=C(C#N)C(=O)NC1c1ccc(cc1)C(C)(C)C)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 C22H23N3O2S MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O2S/c1-22(2,3)15-7-5-14(6-8-15)19-24-20(26)18(13-23)21(28)25(19)16-9-11-17(27-4)12-10-16/h5-12,19,28H,1-4H3,(H,24,26)InChIKey
ZMOLEMBGNLTDPO-UHFFFAOYSA-NSynonyms
2(4(TERTBUTYL)PHENYL)3(4METHOXYPHENYL)6OXO4SULFANYL123TRIHYDROPYRIMIDINE5CARBONITRILE
2(4tertbutylphenyl)1(4methoxyphenyl)4oxo6sulfanyl1234tetrahydropyrimidine5carbonitrile
2(4TERTBUTYLPHENYL)3(4METHOXYPHENYL)6OXO4SULFANYL12DIHYDROPYRIMIDINE5CARBONITRILE
CC(C)(C)C1=CC=C(C=C1)C2NC(=O)C(=C(N2C3=CC=C(C=C3)OC)S)C#N
InChI=1SC22H23N3O2Sc122(23)157514(6815)192420(26)18(1323)21(28)25(19)1691117(274)121016h5121928H14H3(H2426)
MFCD05847257
ZINC000004513623
ZINC000004513626
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