Vitas-M small molecule compound
2-{[3-(4-methylphenyl)-4-oxo-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
STL332640
SMILES O=C(C(Sc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)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 C28H29N3O3S2 MW 519.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3S2/c1-16(2)22-14-21-23(15-34-22)36-26-24(21)27(33)31(20-12-10-17(3)11-13-20)28(30-26)35-18(4)25(32)29-19-8-6-5-7-9-19/h5-13,16,18,22H,14-15H2,1-4H3,(H,29,32)InChIKey
JEMMNCGQYKYZJL-UHFFFAOYSA-NSynonyms
371128-40-42((3(4methylphenyl)4oxo6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)Nphenylpropanamide
2((3(4methylphenyl)4oxo6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)Nphenylpropanamide
2((6isopropyl4oxo3(ptolyl)4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)Nphenylpropanamide
371128404
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC(C)C(=O)NC4=CC=CC=C4)SC5=C3CC(OC5)C(C)C
InChI=1SC28H29N3O3S2c116(2)22142123(153422)362624(21)27(33)31(20121017(3)111320)28(3026)3518(4)25(32)29198657919h513161822H1415H214H3(H2932)
MFCD03008237
ZINC000002314211
ZINC000002314214
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