Vitas-M small molecule compound
N-benzyl-2-[3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STK640792
SMILES O=C(Cn1c(=O)n(C2CCOC(C2)(C)C)c(=O)c2c1sc1c2CCCC1)NCc1ccccc1
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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 C26H31N3O4S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O4S/c1-26(2)14-18(12-13-33-26)29-23(31)22-19-10-6-7-11-20(19)34-24(22)28(25(29)32)16-21(30)27-15-17-8-4-3-5-9-17/h3-5,8-9,18H,6-7,10-16H2,1-2H3,(H,27,30)InChIKey
MHZKSFRNCQRALM-UHFFFAOYSA-NSynonyms
1010899-79-21010899792
CC1(CC(CCO1)N2C(=O)C3=C(N(C2=O)CC(=O)NCC4=CC=CC=C4)SC5=C3CCCC5)C
InChI=1SC26H31N3O4Sc126(2)1418(12133326)2923(31)221910671120(19)3424(22)28(25(29)32)1621(30)2715178435917h358918H671016H212H3(H2730)
MFCD12202590
Nbenzyl2(3(22dimethyloxan4yl)24dioxo5678tetrahydro(1)benzothiolo(23d)pyrimidin1yl)acetamide
Nbenzyl2(3(22dimethyltetrahydro2Hpyran4yl)24dioxo345678hexahydro(1)benzothieno(23d)pyrimidin1(2H)yl)acetamide
Nbenzyl2(3(22dimethyltetrahydro2Hpyran4yl)24dioxo345678hexahydrobenzo(45)thieno(23d)pyrimidin1(2H)yl)acetamide
ZINC000012391131
ZINC000012391132
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