Vitas-M small molecule compound
ethyl 4-(4-tert-butylphenyl)-3'-(4-methylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK535307
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)C(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 C35H34N4O2S MW 574.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34N4O2S/c1-6-41-33(40)32-37-39(28-22-16-24(2)17-23-28)35(42-32)30-15-11-10-14-29(30)31(36-38(35)27-12-8-7-9-13-27)25-18-20-26(21-19-25)34(3,4)5/h7-23H,6H2,1-5H3InChIKey
TWYGSNTUMUIDAY-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)C
ethyl4(4(tertbutyl)phenyl)2phenyl3(ptolyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ethyl4(4tertbutylphenyl)3(4methylphenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4TERTBUTYLPHENYL)4(4METHYLPHENYL)2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC35H34N4O2Sc164133(40)323739(28221624(2)172328)35(4232)301511101429(30)31(3638(35)27128791327)25182026(211925)34(34)5h723H6H215H3
MFCD02235507
ZINC000102415996
ZINC000102416000
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