Vitas-M small molecule compound
2,2-dimethyl-5-(morpholin-4-yl)-8-[(4-nitrobenzyl)sulfanyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK606255
SMILES [O-][N+](=O)c1ccc(cc1)CSc1ncnc2c1sc1c2c2CC(C)(C)CCc2c(n1)N1CCOCC1
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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 C26H27N5O3S2 MW 521.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3S2/c1-26(2)8-7-18-19(13-26)20-21-22(36-24(20)29-23(18)30-9-11-34-12-10-30)25(28-15-27-21)35-14-16-3-5-17(6-4-16)31(32)33/h3-6,15H,7-14H2,1-2H3InChIKey
BGHAFARUGNXUAD-UHFFFAOYSA-NSynonyms
844651-40-7(O)(N+)(=O)c1ccc(cc1)CSc1ncnc2c1sc1c2c2CC(C)(C)CCc2c(n1)N1CCOCC1
22dimethyl5(morpholin4yl)8((4nitrobenzyl)sulfanyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
4(22dimethyl8((4nitrobenzyl)thio)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin5yl)morpholine
844651407
CC1(CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)SCC5=CC=C(C=C5)(N+)(=O)(O))N6CCOCC6)C
InChI=1SC26H27N5O3S2c126(2)871819(1326)202122(3624(20)2923(18)3091134121030)25(28152721)3514163517(6416)31(32)33h3615H714H212H3
MFCD04158526
ZINC000020358156
ZINC20358156
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