Vitas-M small molecule compound
ethyl 3'-(4-methylphenyl)-2-phenyl-4-[4-(propan-2-yl)phenyl]-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK536289
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)C(C)C)c1ccccc1)c1ccc(cc1)C
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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 C34H32N4O2S MW 560.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32N4O2S/c1-5-40-33(39)32-36-38(28-21-15-24(4)16-22-28)34(41-32)30-14-10-9-13-29(30)31(26-19-17-25(18-20-26)23(2)3)35-37(34)27-11-7-6-8-12-27/h6-23H,5H2,1-4H3InChIKey
ODOVAKLRKFJGGH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(=NN2C4=CC=CC=C4)C5=CC=C(C=C5)C(C)C)C6=CC=C(C=C6)C
ethyl3(4methylphenyl)2phenyl4(4(propan2yl)phenyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ethyl4(4isopropylphenyl)2phenyl3(ptolyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4METHYLPHENYL)2PHENYL4(4PROPAN2YLPHENYL)SPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC34H32N4O2Sc154033(39)323638(28211524(4)162228)34(4132)30141091329(30)31(26191725(182026)23(2)3)3537(34)27117681227h623H5H214H3
MFCD01575607
ZINC000102418389
ZINC000102418392
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