Vitas-M small molecule compound
8-benzyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK722768
SMILES O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCN(C3)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 C31H25N5O2S2 MW 563.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N5O2S2/c37-25(22-12-6-2-7-13-22)20-39-31-33-32-30-35(23-14-8-3-9-15-23)28(38)27-24-16-17-34(18-21-10-4-1-5-11-21)19-26(24)40-29(27)36(30)31/h1-15H,16-20H2InChIKey
HQFWLELTQDFFOT-UHFFFAOYSA-NSynonyms
8benzyl1((2oxo2phenylethyl)sulfanyl)4phenyl6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
8benzyl1((2oxo2phenylethyl)thio)4phenyl6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
C1CN(CC2=C1C3=C(S2)N4C(=NN=C4SCC(=O)C5=CC=CC=C5)N(C3=O)C6=CC=CC=C6)CC7=CC=CC=C7
InChI=1SC31H25N5O2S2c3725(22126271322)20393133323035(23148391523)28(38)2724161734(1821104151121)1926(24)4029(27)36(30)31h115H1620H2
MFCD02239912
ZINC000102669908
ZINC102669908
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