Vitas-M small molecule compound
propan-2-yl 5-(3-bromophenyl)-2-(ethylsulfanyl)-7-methyl-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980941
SMILES CCSc1nc2NC(=C(C(c2c(=O)[nH]1)c1cccc(c1)Br)C(=O)OC(C)C)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 C20H22BrN3O3S MW 464.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrN3O3S/c1-5-28-20-23-17-16(18(25)24-20)15(12-7-6-8-13(21)9-12)14(11(4)22-17)19(26)27-10(2)3/h6-10,15H,5H2,1-4H3,(H2,22,23,24,25)InChIKey
IIJGOADXXQAZQF-UHFFFAOYSA-NSynonyms
537045-94-6537045946
CCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=CC(=CC=C3)Br)C(=O)OC(C)C)C
CCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1cccc(c1)Br)C(=O)OC(C)C)C
InChI=1SC20H22BrN3O3Sc152820231716(18(25)2420)15(1276813(21)912)14(11(4)2217)19(26)2710(2)3h61015H5H214H3(H222232425)
MFCD04457420
propan2yl5(3bromophenyl)2(ethylsulfanyl)7methyl4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
PROPAN2YL5(3BROMOPHENYL)2ETHYLSULFANYL7METHYL4OXO58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
ZINC000009415347
ZINC000009415351
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