Vitas-M small molecule compound
7-benzyl-3-(4-methoxyphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK524949
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1
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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 C31H27N3O3S2 MW 553.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O3S2/c1-37-24-14-12-23(13-15-24)34-30(36)28-25-16-17-33(18-21-8-4-2-5-9-21)19-27(25)39-29(28)32-31(34)38-20-26(35)22-10-6-3-7-11-22/h2-15H,16-20H2,1H3InChIKey
ZNXUSNDGRZKZJM-UHFFFAOYSA-NSynonyms
7benzyl3(4methoxyphenyl)2((2oxo2phenylethyl)sulfanyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl3(4methoxyphenyl)2((2oxo2phenylethyl)thio)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl3(4methoxyphenyl)2phenacylsulfanyl68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=CC=C4)SC5=C3CCN(C5)CC6=CC=CC=C6
InChI=1SC31H27N3O3S2c13724141223(131524)3430(36)2825161733(18218425921)1927(25)3929(28)3231(34)382026(35)22106371122h215H1620H21H3
MFCD01878065
ZINC000053291663
ZINC53291663
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