Vitas-M small molecule compound
2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-chloro-2-methylphenyl)acetamide
Catalog ID
STL050804
SMILES Brc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)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 C25H21BrClN3O2S2 MW 574.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrClN3O2S2/c1-14-12-16(27)8-11-19(14)28-21(31)13-33-25-29-23-22(18-4-2-3-5-20(18)34-23)24(32)30(25)17-9-6-15(26)7-10-17/h6-12H,2-5,13H2,1H3,(H,28,31)InChIKey
FGMYANFAXQHFSR-UHFFFAOYSA-NSynonyms
476484-32-92((3(4bromophenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(4chloro2methylphenyl)acetamide
2((3(4bromophenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(4chloro2methylphenyl)acetamide
2((3(4bromophenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(4chloro2methylphenyl)acetamide
476484329
CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Br
InChI=1SC25H21BrClN3O2S2c1141216(27)81119(14)2821(31)133325292322(18423520(18)3423)24(32)30(25)179615(26)71017h612H2513H21H3(H2831)
MFCD03473598
ZINC000001878100
ZINC01878100
ZINC1878100
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