Vitas-M small molecule compound
dipropan-2-yl 2,6-dimethyl-4-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK800669
SMILES CCCSc1ccc(cc1)c1nn(cc1C1C(=C(C)NC(=C1C(=O)OC(C)C)C)C(=O)OC(C)C)c1ccccc1
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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 C33H39N3O4S MW 573.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O4S/c1-8-18-41-26-16-14-24(15-17-26)31-27(19-36(35-31)25-12-10-9-11-13-25)30-28(32(37)39-20(2)3)22(6)34-23(7)29(30)33(38)40-21(4)5/h9-17,19-21,30,34H,8,18H2,1-7H3InChIKey
RBXALYVEIIVFDS-UHFFFAOYSA-NSynonyms
CCCSC1=CC=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OC(C)C)C)C)C(=O)OC(C)C)C4=CC=CC=C4
dipropan2yl26dimethyl4(1phenyl3(4(propylsulfanyl)phenyl)1Hpyrazol4yl)14dihydropyridine35dicarboxylate
DIPROPAN2YL26DIMETHYL4(1PHENYL3(4PROPYLSULFANYLPHENYL)PYRAZOL4YL)14DIHYDROPYRIDINE35DICARBOXYLATE
InChI=1SC33H39N3O4Sc18184126161424(151726)3127(1936(3531)2512109111325)3028(32(37)3920(2)3)22(6)3423(7)29(30)33(38)4021(4)5h91719213034H818H217H3
MFCD05022397
ZINC000098046718
ZINC98046718
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