Vitas-M small molecule compound
2-[({[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]-5-phenylthiophene-3-carboxamide
Catalog ID
STL307093
SMILES C=CCn1c(SCC(=O)Nc2sc(cc2C(=O)N)c2ccccc2)nc2c(c1=O)c1CCCc1s2
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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 C25H22N4O3S3 MW 522.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3S3/c1-2-11-29-24(32)20-15-9-6-10-17(15)34-23(20)28-25(29)33-13-19(30)27-22-16(21(26)31)12-18(35-22)14-7-4-3-5-8-14/h2-5,7-8,12H,1,6,9-11,13H2,(H2,26,31)(H,27,30)InChIKey
CYMXLOZOTIPGQQ-UHFFFAOYSA-NSynonyms
2((((4oxo3(prop2en1yl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)5phenylthiophene3carboxamide
2((2((1oxo2prop2enyl78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin3yl)sulfanyl)acetyl)amino)5phenylthiophene3carboxamide
C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N)SC5=C2CCC5
InChI=1SC25H22N4O3S3c12112924(32)2015961017(15)3423(20)2825(29)331319(30)272216(21(26)31)1218(3522)147435814h257812H1691113H2(H22631)(H2730)
MFCD03964465
ZINC000003267065
ZINC03267065
ZINC3267065
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