Vitas-M small molecule compound
ethyl 4-(4-tert-butylphenyl)-3'-(4-chlorophenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK663401
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)C(C)(C)C)c1ccccc1)c1ccc(cc1)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(27-21-19-25(35)20-22-27)34(42-31)29-14-10-9-13-28(29)30(36-38(34)26-11-7-6-8-12-26)23-15-17-24(18-16-23)33(2,3)4/h6-22H,5H2,1-4H3InChIKey
NIVVFTLFDSOUOI-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=C(C=C6)Cl
ethyl4(4(tertbutyl)phenyl)3(4chlorophenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ethyl4(4tertbutylphenyl)3(4chlorophenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4TERTBUTYLPHENYL)4(4CHLOROPHENYL)2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC34H31ClN4O2Sc154132(40)313739(27211925(35)202227)34(4231)29141091328(29)30(3638(34)26117681226)23151724(181623)33(23)4h622H5H214H3
MFCD01819579
ZINC000097999448
ZINC000097999449
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