Vitas-M small molecule compound
3-(4-bromophenyl)-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK055112
SMILES COc1cccc(c1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Br)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 C25H21BrN2O3S2 MW 541.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrN2O3S2/c1-31-18-6-4-5-15(13-18)20(29)14-32-25-27-23-22(19-7-2-3-8-21(19)33-23)24(30)28(25)17-11-9-16(26)10-12-17/h4-6,9-13H,2-3,7-8,14H2,1H3InChIKey
ZSLJRLZHQPUKOV-UHFFFAOYSA-NSynonyms
498545-52-13(4bromophenyl)2((2(3methoxyphenyl)2oxoethyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4bromophenyl)2((2(3methoxyphenyl)2oxoethyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4bromophenyl)2(2(3methoxyphenyl)2oxoethyl)sulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
498545521
COC1=CC=CC(=C1)C(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Br
COc1cccc(c1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Br)CCCC3
InChI=1SC25H21BrN2O3S2c1311864515(1318)20(29)143225272322(19723821(19)3323)24(30)28(25)1711916(26)101217h46913H237814H21H3
MFCD03223098
STK055112
ZINC000100667036
ZINC100667036
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