Vitas-M small molecule compound
ethyl 4-[4-(2-methoxyphenyl)-6-oxo-3-(thiophen-2-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoate
Catalog ID
STK779863
SMILES CCOC(=O)c1ccc(cc1)N1C(c2ccccc2OC)c2c(C1=O)[nH]nc2c1cccs1
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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 C25H21N3O4S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4S/c1-3-32-25(30)15-10-12-16(13-11-15)28-23(17-7-4-5-8-18(17)31-2)20-21(19-9-6-14-33-19)26-27-22(20)24(28)29/h4-14,23H,3H2,1-2H3,(H,26,27)InChIKey
VJRDMWHREGMSGM-UHFFFAOYSA-NSynonyms
727663-18-5727663185
CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C4=CC=CS4)C5=CC=CC=C5OC
CCOC(=O)c1ccc(cc1)N1C(c2ccccc2OC)c2c(C1=O)(nH)nc2c1cccs1
ETHYL4(4(2METHOXYPHENYL)6OXO3(2THIENYL)3PYRROLINO(34D)PYRAZOL5YL)BENZOATE
ethyl4(4(2methoxyphenyl)6oxo3(thiophen2yl)46dihydropyrrolo(34c)pyrazol5(1H)yl)benzoate
ETHYL4(4(2METHOXYPHENYL)6OXO3THIOPHEN2YL24DIHYDROPYRROLO(34C)PYRAZOL5YL)BENZOATE
InChI=1SC25H21N3O4Sc133225(30)15101216(131115)2823(17745818(17)312)2021(1996143319)262722(20)24(28)29h41423H3H212H3(H2627)
MFCD05859394
ZINC000001430339
ZINC000001430340
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