Vitas-M small molecule compound
propan-2-yl 7-methyl-2-[(4-nitrobenzyl)sulfanyl]-4-oxo-5-(pyridin-4-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981001
SMILES CC(OC(=O)C1=C(C)Nc2c(C1c1ccncc1)c(=O)[nH]c(n2)SCc1ccc(cc1)[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 C24H23N5O5S MW 493.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O5S/c1-13(2)34-23(31)18-14(3)26-21-20(19(18)16-8-10-25-11-9-16)22(30)28-24(27-21)35-12-15-4-6-17(7-5-15)29(32)33/h4-11,13,19H,12H2,1-3H3,(H2,26,27,28,30)InChIKey
XATPYTDNALGDPO-UHFFFAOYSA-NSynonyms
537663-64-2537663642
CC(OC(=O)C1=C(C)Nc2c(C1c1ccncc1)c(=O)(nH)c(n2)SCc1ccc(cc1)(N+)(=O)(O))C
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=NC=C4)C(=O)OC(C)C
InChI=1SC24H23N5O5Sc113(2)3423(31)1814(3)262120(19(18)168102511916)22(30)2824(2721)3512154617(7515)29(32)33h4111319H12H213H3(H226272830)
MFCD04457448
propan2yl7methyl2((4nitrobenzyl)sulfanyl)4oxo5(pyridin4yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
PROPAN2YL7METHYL2((4NITROPHENYL)METHYLSULFANYL)4OXO5PYRIDIN4YL58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
ZINC000009393884
ZINC000009393888
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