Vitas-M small molecule compound
ethyl 4-(4-tert-butylphenyl)-3'-(3-chlorophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK733674
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)C(C)(C)C)c1ccccc1)c1cccc(c1)Cl
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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 C34H31ClN4O2S MW 595.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H31ClN4O2S/c1-5-41-32(40)31-37-39(27-15-11-12-25(35)22-27)34(42-31)29-17-10-9-16-28(29)30(36-38(34)26-13-7-6-8-14-26)23-18-20-24(21-19-23)33(2,3)4/h6-22H,5H2,1-4H3InChIKey
FNFRCTNRBYTGQH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(=NN2C4=CC=CC=C4)C5=CC=C(C=C5)C(C)(C)C)C6=CC(=CC=C6)Cl
ethyl4(4(tertbutyl)phenyl)3(3chlorophenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ethyl4(4tertbutylphenyl)3(3chlorophenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4TERTBUTYLPHENYL)4(3CHLOROPHENYL)2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC34H31ClN4O2Sc154132(40)313739(2715111225(35)2227)34(4231)29171091628(29)30(3638(34)26137681426)23182024(211923)33(23)4h622H5H214H3
MFCD02241267
ZINC000102659699
ZINC000102659703
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