Vitas-M small molecule compound
7-benzyl-2-(3,5-diiodo-2-methoxyphenyl)-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK382335
SMILES COc1c(I)cc(cc1C1NC(=O)c2c(N1)sc1c2CCN(C1)Cc1ccccc1)I
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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 C23H21I2N3O2S MW 657.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21I2N3O2S/c1-30-20-16(9-14(24)10-17(20)25)21-26-22(29)19-15-7-8-28(11-13-5-3-2-4-6-13)12-18(15)31-23(19)27-21/h2-6,9-10,21,27H,7-8,11-12H2,1H3,(H,26,29)InChIKey
DRFXUMNXYSTFAV-UHFFFAOYSA-NSynonyms
7benzyl2(35diiodo2methoxyphenyl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7benzyl2(35diiodo2methoxyphenyl)235678hexahydropyrido(4345)thieno(23d)pyrimidin4(1H)one
COC1=C(C=C(C=C1C2NC3=C(C4=C(S3)CN(CC4)CC5=CC=CC=C5)C(=O)N2)I)I
InChI=1SC23H21I2N3O2Sc1302016(914(24)1017(20)25)212622(29)19157828(11135324613)1218(15)3123(19)2721h269102127H781112H21H3(H2629)
MFCD02915774
ZINC000150397957
ZINC000150397959
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