Vitas-M small molecule compound
2-[(Z)-2-(2-nitrophenyl)ethenyl]-7-(propan-2-yl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK384379
SMILES CC(N1CCc2c(C1)sc1c2C(=NC(N1)/C=C\c1ccccc1[N+](=O)[O-])O)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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-12(2)23-10-9-14-16(11-23)28-20-18(14)19(25)21-17(22-20)8-7-13-5-3-4-6-15(13)24(26)27/h3-8,12,17,22H,9-11H2,1-2H3,(H,21,25)/b8-7-InChIKey
FGYKSHWCGODLHU-FPLPWBNLSA-NSynonyms
2((Z)2(2nitrophenyl)ethenyl)7(propan2yl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
2((Z)2(2nitrophenyl)ethenyl)7propan2yl123568hexahydropyrido(23)thieno(24d)pyrimidin4one
CC(C)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C=CC4=CC=CC=C4(N+)(=O)(O)
CC(N1CCc2c(C1)sc1c2C(=NC(N1)C=Cc1ccccc1(N+)(=O)(O))O)C
InChI=1SC20H22N4O3Sc112(2)231091416(1123)282018(14)19(25)2117(2220)8713534615(13)24(26)27h38121722H911H212H3(H2125)b87
MFCD04041563
ZINC000004555311
ZINC000004555312
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