Vitas-M small molecule compound
ethyl 2-[({[4-(4-chlorophenyl)phthalazin-1-yl]sulfanyl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK887695
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(c3c2cccc3)c2ccc(cc2)Cl)sc(c1C)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 C25H22ClN3O3S2 MW 512.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O3S2/c1-4-32-25(31)21-14(2)15(3)34-24(21)27-20(30)13-33-23-19-8-6-5-7-18(19)22(28-29-23)16-9-11-17(26)12-10-16/h5-12H,4,13H2,1-3H3,(H,27,30)InChIKey
BTIVIJDMXGSZPR-UHFFFAOYSA-NSynonyms
938037-46-8938037468
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)Cl
ethyl2((((4(4chlorophenyl)phthalazin1yl)sulfanyl)acetyl)amino)45dimethylthiophene3carboxylate
ethyl2((2(4(4chlorophenyl)phthalazin1yl)sulfanylacetyl)amino)45dimethylthiophene3carboxylate
ETHYL2(2(4(4CHLOROPHENYL)PHTHALAZINYLTHIO)ACETYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
InChI=1SC25H22ClN3O3S2c143225(31)2114(2)15(3)3424(21)2720(30)13332319865718(19)22(282923)1691117(26)121016h512H413H213H3(H2730)
MFCD08532735
ZINC000012176770
ZINC12176770
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