Vitas-M small molecule compound

3,7-dibenzyl-2-(heptylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK039287
SMILES CCCCCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)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 C30H35N3OS2 MW 517.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3OS2/c1-2-3-4-5-12-19-35-30-31-28-27(29(34)33(30)21-24-15-10-7-11-16-24)25-17-18-32(22-26(25)36-28)20-23-13-8-6-9-14-23/h6-11,13-16H,2-5,12,17-22H2,1H3
InChIKey
TTZXPGUVGPJMRM-UHFFFAOYSA-N
Synonyms
364382-90-1
364382901
37dibenzyl2(heptylsulfanyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
37dibenzyl2(heptylthio)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
37dibenzyl2heptylsulfanyl68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
CCCCCCCSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1CC5=CC=CC=C5
CCCCCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCN(C3)Cc1ccccc1
InChI=1SC30H35N3OS2c1234512193530312827(29(34)33(30)212415107111624)25171832(2226(25)3628)2023138691423h6111316H25121722H21H3
MFCD01563079
STK039287
ZINC000097949632
ZINC97949632

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Available files

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