ethyl 5-[(3,4-dichlorophenyl)carbonylamino]-3-(3-methylbutyl)-2-methylsulfanyl-imidazole-4-carboxylate

Systemtic Name: ethyl 5-[(3,4-dichlorophenyl)carbonylamino]-3-(3-methylbutyl)-2-methylsulfanyl-imidazole-4-carboxylate Openeye Name: ethyl 5-[(3,4-dichlorobenzoyl)amino]-3-isopentyl-2-methylsulfanyl-imidazole-4-carboxylate CAS Name: 5-[[(3,4-dichlorophenyl)-oxomethyl]amino]-3-(3-methylbutyl)-2-(methylthio)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3,4-dichlorobenzoyl)amino]-3-(3-methylbutyl)-2-methylsulfanylimidazole-4-carboxylate Traditional Name: 5-[(3,4-dichlorobenzoyl)amino]-3-isoamyl-2-(methylthio)imidazole-4-carboxylic acid ethyl ester Formula: C19H23Cl2N3O3S MolecularWeight: 444.37522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1CCC(C)C)SC)NC(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1CCC(C)C)SC)NC(=O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H23Cl2N3O3S/c1-5-27-18(26)15-16(23-19(28-4)24(15)9-8-11(2)3)22-17(25)12-6-7-13(20)14(21)10-12/h6-7,10-11H,5,8-9H2,1-4H3,(H,22,25)