Vitas-M small molecule compound
ethyl 1-(4-chlorophenyl)-4-[4-(dimethylamino)phenyl]-5-(1H-indol-3-yl)-4,5-dihydro-1H-1,2,4-triazole-3-carboxylate
Catalog ID
STK723671
SMILES CCOC(=O)C1=NN(C(N1c1ccc(cc1)N(C)C)c1c[nH]c2c1cccc2)c1ccc(cc1)Cl
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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 C27H26ClN5O2 MW 487.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN5O2/c1-4-35-27(34)25-30-33(21-11-9-18(28)10-12-21)26(23-17-29-24-8-6-5-7-22(23)24)32(25)20-15-13-19(14-16-20)31(2)3/h5-17,26,29H,4H2,1-3H3InChIKey
YKYOOBJQYNZNIL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C(N1c1ccc(cc1)N(C)C)c1c(nH)c2c1cccc2)c1ccc(cc1)Cl
CCOC(=O)C1=NN(C(N1C2=CC=C(C=C2)N(C)C)C3=CNC4=CC=CC=C43)C5=CC=C(C=C5)Cl
ethyl1(4chlorophenyl)4(4(dimethylamino)phenyl)5(1Hindol3yl)45dihydro1H124triazole3carboxylate
ethyl2(4chlorophenyl)4(4(dimethylamino)phenyl)3(1Hindol3yl)3H124triazole5carboxylate
ETHYL2(4CHLOROPHENYL)4(4DIMETHYLAMINOPHENYL)3(1HINDOL3YL)3H124TRIAZOLE5CARBOXYLATE
ETHYL4(4(DIMETHYLAMINO)PHENYL)1(4CHLOROPHENYL)5INDOL3YL124TRIAZOLINE3CARBOXYLATE
InChI=1SC27H26ClN5O2c143527(34)253033(2111918(28)101221)26(23172924865722(23)24)32(25)20151319(141620)31(2)3h5172629H4H213H3
MFCD02236170
ZINC000002294428
ZINC000002294429
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