Vitas-M small molecule compound
N-(3-hydroxypropyl)-4-({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzamide
Catalog ID
STL079609
SMILES OCCCNC(=O)c1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1CC=C)CCCC3
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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 C24H27N3O3S2 MW 469.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O3S2/c1-2-13-27-23(30)20-18-6-3-4-7-19(18)32-22(20)26-24(27)31-15-16-8-10-17(11-9-16)21(29)25-12-5-14-28/h2,8-11,28H,1,3-7,12-15H2,(H,25,29)InChIKey
GEDVJJVORLIEND-UHFFFAOYSA-NSynonyms
325693-38-7325693387
4(((3allyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)methyl)N(3hydroxypropyl)benzamide
C=CCN1C(=O)C2=C(N=C1SCC3=CC=C(C=C3)C(=O)NCCCO)SC4=C2CCCC4
InChI=1SC24H27N3O3S2c12132723(30)2018634719(18)3222(20)2624(27)31151681017(11916)21(29)251251428h281128H1371215H2(H2529)
MFCD01949567
N(3hydroxypropyl)4(((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)methyl)benzamide
N(3hydroxypropyl)4((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanylmethyl)benzamide
ZINC000002282172
ZINC02282172
ZINC2282172
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