ethyl 2-[(4-cyanophenyl)carbonyl-pentyl-amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4-cyanophenyl)carbonyl-pentyl-amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4-cyanobenzoyl)-pentyl-amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(4-cyanophenyl)-oxomethyl]-pentylamino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-cyanobenzoyl)-pentylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-(4-cyanobenzoyl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H23N3O3S/c1-4-6-7-12-23(18(24)16-10-8-15(13-21)9-11-16)20-22-14(3)17(27-20)19(25)26-5-2/h8-11H,4-7,12H2,1-3H3