Vitas-M small molecule compound
2-{4-[3-(4-tert-butylphenoxy)propoxy]-3-methoxyphenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK383108
SMILES COc1cc(ccc1OCCCOc1ccc(cc1)C(C)(C)C)c1nc2sc3c(c2c(=O)[nH]1)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 C30H34N2O4S MW 518.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O4S/c1-30(2,3)20-11-13-21(14-12-20)35-16-7-17-36-23-15-10-19(18-24(23)34-4)27-31-28(33)26-22-8-5-6-9-25(22)37-29(26)32-27/h10-15,18H,5-9,16-17H2,1-4H3,(H,31,32,33)InChIKey
HLUILAWRQHTTGI-UHFFFAOYSA-NSynonyms
2(4(3(4tertbutylphenoxy)propoxy)3methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4(3(4tertbutylphenoxy)propoxy)3methoxyphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1=CC=C(C=C1)OCCCOC2=C(C=C(C=C2)C3=NC4=C(C5=C(S4)CCCC5)C(=O)N3)OC
COc1cc(ccc1OCCCOc1ccc(cc1)C(C)(C)C)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC30H34N2O4Sc130(23)20111321(141220)35167173623151019(1824(23)344)273128(33)2622856925(22)3729(26)3227h101518H591617H214H3(H313233)
MFCD03835485
ZINC000004113182
ZINC04113182
ZINC4113182
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