Vitas-M small molecule compound
2-(3-cyclohexyl-6,6-dimethyl-2,4-dioxo-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl)-N-(naphthalen-1-yl)acetamide
Catalog ID
STL477351
SMILES O=C(Nc1cccc2c1cccc2)Cn1c(=O)n(C2CCCCC2)c(=O)c2c1sc1c2CC(OC1)(C)C
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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 C29H31N3O4S MW 517.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O4S/c1-29(2)15-21-23(17-36-29)37-27-25(21)26(34)32(19-11-4-3-5-12-19)28(35)31(27)16-24(33)30-22-14-8-10-18-9-6-7-13-20(18)22/h6-10,13-14,19H,3-5,11-12,15-17H2,1-2H3,(H,30,33)InChIKey
FLVCKWJUBIFAII-UHFFFAOYSA-NSynonyms
2(3cyclohexyl66dimethyl24dioxo3458tetrahydro2Hpyrano(4345)thieno(23d)pyrimidin1(6H)yl)N(naphthalen1yl)acetamide
2(3cyclohexyl66dimethyl24dioxo58dihydropyrano(23)thieno(24b)pyrimidin1yl)Nnaphthalen1ylacetamide
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3CC(=O)NC4=CC=CC5=CC=CC=C54)C6CCCCC6)C
InChI=1SC29H31N3O4Sc129(2)152123(173629)372725(21)26(34)32(19114351219)28(35)31(27)1624(33)302214810189671320(18)22h610131419H3511121517H212H3(H3033)
MFCD07773645
ZINC000008769955
ZINC08769955
ZINC8769955
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