Vitas-M small molecule compound

ethyl 3'-(4-methoxyphenyl)-2-phenyl-4-[4-(propan-2-yl)phenyl]-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate

Catalog ID
STK331140
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)C(C)C)c1ccccc1)c1ccc(cc1)OC

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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 C34H32N4O3S MW 576.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32N4O3S/c1-5-41-33(39)32-36-38(27-19-21-28(40-4)22-20-27)34(42-32)30-14-10-9-13-29(30)31(25-17-15-24(16-18-25)23(2)3)35-37(34)26-11-7-6-8-12-26/h6-23H,5H2,1-4H3
InChIKey
ANNVIDPEBLNZJI-UHFFFAOYSA-N
Synonyms

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)OC
ethyl3(4methoxyphenyl)2phenyl4(4(propan2yl)phenyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ethyl4(4isopropylphenyl)3(4methoxyphenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4METHOXYPHENYL)2PHENYL4(4PROPAN2YLPHENYL)SPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC34H32N4O3Sc154133(39)323638(27192128(404)222027)34(4232)30141091329(30)31(25171524(161825)23(2)3)3537(34)26117681226h623H5H214H3
MFCD00754978
ZINC000033358280
ZINC000033358281

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Available files

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