Vitas-M small molecule compound
propan-2-yl 6-(3-butoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
Catalog ID
STK106604
SMILES CCCCOc1cccc(c1)C1NC(=NC(=C1C(=O)OC(C)C)C)S
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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 C19H26N2O3S MW 362.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N2O3S/c1-5-6-10-23-15-9-7-8-14(11-15)17-16(18(22)24-12(2)3)13(4)20-19(25)21-17/h7-9,11-12,17H,5-6,10H2,1-4H3,(H2,20,21,25)InChIKey
CTWDCVSGPRGJPS-UHFFFAOYSA-NSynonyms
CCCCOC1=CC=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C
InChI=1SC19H26N2O3Sc15610231597814(1115)1716(18(22)2412(2)3)13(4)2019(25)2117h79111217H5610H214H3(H2202125)
MFCD03716445
PROPAN2YL4(3BUTOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
PROPAN2YL6(3BUTOXYPHENYL)4METHYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
ZINC000004680126
ZINC000004680127
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