[2-[ethanoyl-(4-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 1H-indazole-3-carboxylate

Systemtic Name: [2-[ethanoyl-(4-ethylphenyl)amino]-1,3-thiazol-4-yl]methyl 1H-indazole-3-carboxylate Openeye Name: [2-(N-acetyl-4-ethyl-anilino)thiazol-4-yl]methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [2-(N-acetyl-4-ethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-4-ethylanilino)-1,3-thiazol-4-yl]methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [2-(N-acetyl-4-ethyl-anilino)thiazol-4-yl]methyl ester Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=NNC4=CC=CC=C43)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=NNC4=CC=CC=C43)C(=O)C

InChI

InChI=1S/C22H20N4O3S/c1-3-15-8-10-17(11-9-15)26(14(2)27)22-23-16(13-30-22)12-29-21(28)20-18-6-4-5-7-19(18)24-25-20/h4-11,13H,3,12H2,1-2H3,(H,24,25)