Vitas-M small molecule compound
3-butyl-9-(methoxymethyl)-7-methyl-2-(2-nitrophenyl)pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STK689382
SMILES CCCCn1c(nc2c(c1=O)sc1c2c(COC)cc(n1)C)c1ccccc1[N+](=O)[O-]
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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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c1-4-5-10-25-20(15-8-6-7-9-16(15)26(28)29)24-18-17-14(12-30-3)11-13(2)23-21(17)31-19(18)22(25)27/h6-9,11H,4-5,10,12H2,1-3H3InChIKey
FEQXOIBJJUJRIN-UHFFFAOYSA-NSynonyms
3butyl9(methoxymethyl)7methyl2(2nitrophenyl)pyrido(12)thieno(34b)pyrimidin4one
3butyl9(methoxymethyl)7methyl2(2nitrophenyl)pyrido(3245)thieno(32d)pyrimidin4(3H)one
CCCCN1C(=NC2=C(C1=O)SC3=C2C(=CC(=N3)C)COC)C4=CC=CC=C4(N+)(=O)(O)
CCCCn1c(nc2c(c1=O)sc1c2c(COC)cc(n1)C)c1ccccc1(N+)(=O)(O)
InChI=1SC22H22N4O4Sc145102520(15867916(15)26(28)29)24181714(12303)1113(2)2321(17)3119(18)22(25)27h6911H451012H213H3
MFCD08142441
ZINC000012411000
ZINC12411000
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