Vitas-M small molecule compound
2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Catalog ID
STK045251
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)c1CCCCc1s2
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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 C26H25N3O3S2 MW 491.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S2/c1-16-6-5-7-17(14-16)27-22(30)15-33-26-28-24-23(20-8-3-4-9-21(20)34-24)25(31)29(26)18-10-12-19(32-2)13-11-18/h5-7,10-14H,3-4,8-9,15H2,1-2H3,(H,27,30)InChIKey
KEOZMYVRBVFXPE-UHFFFAOYSA-NSynonyms
477330-41-92((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(3methylphenyl)acetamide
2((3(4methoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(mtolyl)acetamide
2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(3methylphenyl)acetamide
477330419
CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)OC
COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nc2c(c1=O)c1CCCCc1s2
InChI=1SC26H25N3O3S2c11665717(1416)2722(30)153326282423(20834921(20)3424)25(31)29(26)18101219(322)131118h571014H348915H212H3(H2730)
MFCD03223537
STK045251
ZINC000001295236
ZINC01295236
ZINC1295236
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