Vitas-M small molecule compound
ethyl 4-(4-ethylphenyl)-2,3'-diphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STL019075
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)CC)c1ccccc1)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 C32H28N4O2S MW 532.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N4O2S/c1-3-23-19-21-24(22-20-23)29-27-17-11-12-18-28(27)32(35(33-29)25-13-7-5-8-14-25)36(26-15-9-6-10-16-26)34-30(39-32)31(37)38-4-2/h5-22H,3-4H2,1-2H3InChIKey
BKTKQFUMNCEVRN-UHFFFAOYSA-NSynonyms
376371-47-0376371470
CCC1=CC=C(C=C1)C2=NN(C3(C4=CC=CC=C42)N(N=C(S3)C(=O)OCC)C5=CC=CC=C5)C6=CC=CC=C6
ethyl4(4ethylphenyl)23diphenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4ETHYLPHENYL)24DIPHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC32H28N4O2Sc1323192124(222023)29271711121828(27)32(35(3329)25137581425)36(261596101626)3430(3932)31(37)3842h522H34H212H3
MFCD00754964
ZINC000097952485
ZINC000097952486
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