tert-butyl 5-[(3-chloranyl-4-propan-2-ylsulfonyl-thiophen-2-yl)carbonylamino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylate

Systemtic Name: tert-butyl 5-[(3-chloranyl-4-propan-2-ylsulfonyl-thiophen-2-yl)carbonylamino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylate Openeye Name: tert-butyl 5-[(3-chloro-4-isopropylsulfonyl-thiophene-2-carbonyl)amino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylate CAS Name: 5-[[(3-chloro-4-propan-2-ylsulfonyl-2-thiophenyl)-oxomethyl]amino]-2-(dimethylamino)-3-phenyl-4-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(3-chloro-4-propan-2-ylsulfonylthiophene-2-carbonyl)amino]-2-(dimethylamino)-3-phenylimidazole-4-carboxylate Traditional Name: 5-[(3-chloro-4-isopropylsulfonyl-thiophene-2-carbonyl)amino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylic acid tert-butyl ester Formula: C24H29ClN4O5S2 MolecularWeight: 553.09386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CSC(=C1Cl)C(=O)NC2=C(N(C(=N2)N(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)S(=O)(=O)C1=CSC(=C1Cl)C(=O)NC2=C(N(C(=N2)N(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H29ClN4O5S2/c1-14(2)36(32,33)16-13-35-19(17(16)25)21(30)26-20-18(22(31)34-24(3,4)5)29(23(27-20)28(6)7)15-11-9-8-10-12-15/h8-14H,1-7H3,(H,26,30)