Vitas-M small molecule compound

3-phenylpropyl 1,6-dimethyl-4-(5-methylthiophen-2-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK082152
SMILES Cc1ccc(s1)C1NC(=O)N(C(=C1C(=O)OCCCc1ccccc1)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 C21H24N2O3S MW 384.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3S/c1-14-11-12-17(27-14)19-18(15(2)23(3)21(25)22-19)20(24)26-13-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-12,19H,7,10,13H2,1-3H3,(H,22,25)
InChIKey
PUUOTYIECJEBFJ-UHFFFAOYSA-N
Synonyms
347350-50-9
347350509
3phenylpropyl16dimethyl4(5methylthiophen2yl)2oxo1234tetrahydropyrimidine5carboxylate
3PHENYLPROPYL34DIMETHYL6(5METHYL(2THIENYL))2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
3PHENYLPROPYL34DIMETHYL6(5METHYLTHIOPHEN2YL)2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
CC1=CC=C(S1)C2C(=C(N(C(=O)N2)C)C)C(=O)OCCCC3=CC=CC=C3
Cc1ccc(s1)C1NC(=O)N(C(=C1C(=O)OCCCc1ccccc1)C)C
InChI=1SC21H24N2O3Sc114111217(2714)1918(15(2)23(3)21(25)2219)20(24)2613710168546916h4689111219H71013H213H3(H2225)
MFCD01988842
STK082152
ZINC000002775524
ZINC000002775525

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.