Vitas-M small molecule compound

7-methyl-2-[5-(2-nitrophenyl)furan-2-yl]-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one

Catalog ID
STL169587
SMILES CN1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(o1)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 C20H18N4O4S MW 410.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4S/c1-23-9-8-12-16(10-23)29-20-17(12)19(25)21-18(22-20)15-7-6-14(28-15)11-4-2-3-5-13(11)24(26)27/h2-7,18,22H,8-10H2,1H3,(H,21,25)
InChIKey
HQTSRCLUXKOYLF-UHFFFAOYSA-N
Synonyms
353462-38-1
353462381
7methyl2(5(2nitrophenyl)furan2yl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7methyl2(5(2nitrophenyl)furan2yl)235678hexahydropyrido(4345)thieno(23d)pyrimidin4(1H)one
CN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O)
CN1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(o1)c1ccccc1(N+)(=O)(O)
InChI=1SC20H18N4O4Sc123981216(1023)292017(12)19(25)2118(2220)157614(2815)11423513(11)24(26)27h271822H810H21H3(H2125)
MFCD01243223
ZINC000004311368
ZINC000004311369

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Available files

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