Vitas-M small molecule compound
propan-2-yl 2-(benzylsulfanyl)-7-methyl-5-(4-nitrophenyl)-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980950
SMILES CC(OC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)[nH]c(n2)SCc1ccccc1)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 C25H24N4O5S MW 492.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O5S/c1-14(2)34-24(31)19-15(3)26-22-21(20(19)17-9-11-18(12-10-17)29(32)33)23(30)28-25(27-22)35-13-16-7-5-4-6-8-16/h4-12,14,20H,13H2,1-3H3,(H2,26,27,28,30)InChIKey
CZZHHBSTNGKJOV-UHFFFAOYSA-NSynonyms
537046-50-7537046507
CC(OC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)(N+)(=O)(O))c(=O)(nH)c(n2)SCc1ccccc1)C
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC3=CC=CC=C3)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)OC(C)C
InChI=1SC25H24N4O5Sc114(2)3424(31)1915(3)262221(20(19)1791118(121017)29(32)33)23(30)2825(2722)3513167546816h4121420H13H213H3(H226272830)
MFCD04457435
propan2yl2(benzylsulfanyl)7methyl5(4nitrophenyl)4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
PROPAN2YL2BENZYLSULFANYL7METHYL5(4NITROPHENYL)4OXO58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
ZINC000002719546
ZINC000009415393
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