Vitas-M small molecule compound
N,6-dimethyl-4-[4-(2-methylpropoxy)naphthalen-1-yl]-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL431117
SMILES CNC(=O)C1=C(C)NC(=S)NC1c1ccc(c2c1cccc2)OCC(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 C21H25N3O2S MW 383.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2S/c1-12(2)11-26-17-10-9-16(14-7-5-6-8-15(14)17)19-18(20(25)22-4)13(3)23-21(27)24-19/h5-10,12,19H,11H2,1-4H3,(H,22,25)(H2,23,24,27)InChIKey
SURXHMSLUUMAPH-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CC=C(C3=CC=CC=C23)OCC(C)C)C(=O)NC
InChI=1SC21H25N3O2Sc112(2)11261710916(14756815(14)17)1918(20(25)224)13(3)2321(27)2419h5101219H11H214H3(H2225)(H2232427)
MFCD03216374
N6DIMETHYL4(4(2METHYLPROPOXY)NAPHTHALEN1YL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
N6dimethyl4(4(2methylpropoxy)naphthalen1yl)2thioxo1234tetrahydropyrimidine5carboxamide
ZINC000001157918
ZINC000001157919
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