Vitas-M small molecule compound
6-[3-nitro-4-(pyrrolidin-1-yl)phenyl]-3-propyl[1,2,4]triazolo[3,4-a]phthalazine
Catalog ID
STK796568
SMILES CCCc1nnc2n1nc(c1ccc(c(c1)[N+](=O)[O-])N1CCCC1)c1c2cccc1
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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 C22H22N6O2 MW 402.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2/c1-2-7-20-23-24-22-17-9-4-3-8-16(17)21(25-27(20)22)15-10-11-18(19(14-15)28(29)30)26-12-5-6-13-26/h3-4,8-11,14H,2,5-7,12-13H2,1H3InChIKey
UVGKULMJNCFKIR-UHFFFAOYSA-NSynonyms
900884-87-96(3nitro4(pyrrolidin1yl)phenyl)3propyl(124)triazolo(34a)phthalazine
6(3NITRO4PYRROLIDIN1YLPHENYL)3PROPYL(124)TRIAZOLO(34A)PHTHALAZINE
900884879
CCCC1=NN=C2N1N=C(C3=CC=CC=C32)C4=CC(=C(C=C4)N5CCCC5)(N+)(=O)(O)
CCCc1nnc2n1nc(c1ccc(c(c1)(N+)(=O)(O))N1CCCC1)c1c2cccc1
InChI=1SC22H22N6O2c1272023242217943816(17)21(2527(20)22)15101118(19(1415)28(29)30)2612561326h3481114H2571213H21H3
MFCD06777825
ZINC000005271528
ZINC05271528
ZINC5271528
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