Vitas-M small molecule compound
2-{[4-oxo-3-(2-phenylethyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylpropanamide
Catalog ID
STL240142
SMILES O=C(C(Sc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)C(C)C)C)Nc1ccccc1
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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 C29H31N3O3S2 MW 533.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O3S2/c1-18(2)23-16-22-24(17-35-23)37-27-25(22)28(34)32(15-14-20-10-6-4-7-11-20)29(31-27)36-19(3)26(33)30-21-12-8-5-9-13-21/h4-13,18-19,23H,14-17H2,1-3H3,(H,30,33)InChIKey
RSUCRWMUDWRNRL-UHFFFAOYSA-NSynonyms
488852-33-12((4oxo3(2phenylethyl)6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)Nphenylpropanamide
2((4oxo3(2phenylethyl)6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)Nphenylpropanamide
2((6isopropyl4oxo3phenethyl4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)Nphenylpropanamide
488852331
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SC(C)C(=O)NC4=CC=CC=C4)CCC5=CC=CC=C5
InChI=1SC29H31N3O3S2c118(2)23162224(173523)372725(22)28(34)32(151420106471120)29(3127)3619(3)26(33)3021128591321h413181923H1417H213H3(H3033)
MFCD03294704
ZINC000001749206
ZINC000001749215
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