Vitas-M small molecule compound
4-(4-chlorophenyl)-1-methyl-6-(3-nitrophenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Catalog ID
STK695028
SMILES Clc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1cccc(c1)[N+](=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 C19H15ClN4O4 MW 398.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN4O4/c1-22-15-10-23(13-3-2-4-14(9-13)24(27)28)18(25)16(15)17(21-19(22)26)11-5-7-12(20)8-6-11/h2-9,17H,10H2,1H3,(H,21,26)InChIKey
GATBETPIDIOQJJ-UHFFFAOYSA-NSynonyms
4(4chlorophenyl)1methyl6(3nitrophenyl)3467tetrahydro1Hpyrrolo(34d)pyrimidine25dione
4(4chlorophenyl)1methyl6(3nitrophenyl)47dihydro3Hpyrrolo(34d)pyrimidine25dione
Clc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1cccc(c1)(N+)(=O)(O))C
CN1C2=C(C(NC1=O)C3=CC=C(C=C3)Cl)C(=O)N(C2)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC19H15ClN4O4c122151023(1332414(913)24(27)28)18(25)16(15)17(2119(22)26)115712(20)8611h2917H10H21H3(H2126)
MFCD12035260
ZINC000035326664
ZINC000035326667
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