Vitas-M small molecule compound
N-(4-methoxyphenyl)-2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}propanamide
Catalog ID
STK558685
SMILES COc1ccc(cc1)NC(=O)C(Sc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)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 C27H29N5O3S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O3S2/c1-16(25(33)30-17-7-9-18(34-2)10-8-17)36-27-23-22(28-15-29-27)21-19-5-3-4-6-20(19)24(31-26(21)37-23)32-11-13-35-14-12-32/h7-10,15-16H,3-6,11-14H2,1-2H3,(H,30,33)InChIKey
JHNSPDZYIVWFMZ-UHFFFAOYSA-NSynonyms
586999-36-2586999362
CC(C(=O)NC1=CC=C(C=C1)OC)SC2=NC=NC3=C2SC4=NC(=C5CCCCC5=C34)N6CCOCC6
InChI=1SC27H29N5O3S2c116(25(33)30177918(342)10817)36272322(28152927)2119534620(19)24(3126(21)3723)32111335141232h7101516H361114H212H3(H3033)
MFCD04033971
N(4methoxyphenyl)2((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)propanamide
N(4methoxyphenyl)2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)propanamide
ZINC000097954049
ZINC000097954050
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