Vitas-M small molecule compound
N-(3-hydroxypropyl)-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL079446
SMILES OCCCNC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)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 C21H23N3O3S2 MW 429.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S2/c25-12-6-11-22-17(26)13-28-21-23-19-18(15-9-4-5-10-16(15)29-19)20(27)24(21)14-7-2-1-3-8-14/h1-3,7-8,25H,4-6,9-13H2,(H,22,26)InChIKey
VRGATVWDGYORMT-UHFFFAOYSA-NSynonyms
325693-66-1325693661
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)NCCCO
InChI=1SC21H23N3O3S2c25126112217(26)132821231918(159451016(15)2919)20(27)24(21)147213814h137825H46913H2(H2226)
MFCD01949523
N(3hydroxypropyl)2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(3hydroxypropyl)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(3hydroxypropyl)2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000002083070
ZINC02083070
ZINC2083070
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