Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STK795899
SMILES COc1cc(CCNC(=O)CSc2nc3sc4c(c3c(=O)n2c2ccccc2)CCCC4)ccc1OC
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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 C28H29N3O4S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S2/c1-34-21-13-12-18(16-22(21)35-2)14-15-29-24(32)17-36-28-30-26-25(20-10-6-7-11-23(20)37-26)27(33)31(28)19-8-4-3-5-9-19/h3-5,8-9,12-13,16H,6-7,10-11,14-15,17H2,1-2H3,(H,29,32)InChIKey
XIBIPCYMTCLNTP-UHFFFAOYSA-NSynonyms
314260-79-2314260792
COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5)OC
InChI=1SC28H29N3O4S2c13421131218(1622(21)352)14152924(32)173628302625(2010671123(20)3726)27(33)31(28)198435919h3589121316H671011141517H212H3(H2932)
MFCD02233620
N(2(34dimethoxyphenyl)ethyl)2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(2(34dimethoxyphenyl)ethyl)2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
N(34dimethoxyphenethyl)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
ZINC000000947879
ZINC947879
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