ethyl 5-azanyl-2-methylsulfanyl-3-(4-propan-2-ylphenyl)imidazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-2-methylsulfanyl-3-(4-propan-2-ylphenyl)imidazole-4-carboxylate Openeye Name: ethyl 5-amino-3-(4-isopropylphenyl)-2-methylsulfanyl-imidazole-4-carboxylate CAS Name: 5-amino-2-(methylthio)-3-(4-propan-2-ylphenyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-2-methylsulfanyl-3-(4-propan-2-ylphenyl)imidazole-4-carboxylate Traditional Name: 5-amino-2-(methylthio)-3-p-cumenyl-imidazole-4-carboxylic acid ethyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1C2=CC=C(C=C2)C(C)C)SC)N

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1C2=CC=C(C=C2)C(C)C)SC)N

InChI

InChI=1S/C16H21N3O2S/c1-5-21-15(20)13-14(17)18-16(22-4)19(13)12-8-6-11(7-9-12)10(2)3/h6-10H,5,17H2,1-4H3