N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide Openeye Name: N-[1-(2,2-dimethylpropanoyl)-4-piperidyl]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-[1-(2,2-dimethyl-1-oxopropyl)-4-piperidinyl]-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: 2-(methylthio)-3-phenyl-N-(1-pivaloyl-4-piperidyl)imidazole-4-carboxamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(CC1)NC(=O)C2=CN=C(N2C3=CC=CC=C3)SC

Isomeric SMILES

CC(C)(C)C(=O)N1CCC(CC1)NC(=O)C2=CN=C(N2C3=CC=CC=C3)SC

InChI

InChI=1S/C21H28N4O2S/c1-21(2,3)19(27)24-12-10-15(11-13-24)23-18(26)17-14-22-20(28-4)25(17)16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3,(H,23,26)