Vitas-M small molecule compound
N-(4-methoxyphenyl)-4-[(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]butanamide
Catalog ID
STL079652
SMILES COc1ccc(cc1)NC(=O)CCCSc1nc2sc3c(c2c(=O)n1C)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 C22H25N3O3S2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O3S2/c1-25-21(27)19-16-6-3-4-7-17(16)30-20(19)24-22(25)29-13-5-8-18(26)23-14-9-11-15(28-2)12-10-14/h9-12H,3-8,13H2,1-2H3,(H,23,26)InChIKey
MDMSZVGNTXWERZ-UHFFFAOYSA-NSynonyms
637321-17-6637321176
CN1C(=O)C2=C(N=C1SCCCC(=O)NC3=CC=C(C=C3)OC)SC4=C2CCCC4
InChI=1SC22H25N3O3S2c12521(27)1916634717(16)3020(19)2422(25)29135818(26)231491115(282)121014h912H3813H212H3(H2326)
MFCD04218170
N(4methoxyphenyl)4((3methyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)butanamide
N(4methoxyphenyl)4((3methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)butanamide
ZINC000002697165
ZINC02697165
ZINC2697165
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