2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)C2=CC=CN2)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)C2=CC=CN2)C3CCCCC3)C

InChI

InChI=1S/C17H23N3OS/c1-12-13(2)20(14-7-4-3-5-8-14)17(19-12)22-11-16(21)15-9-6-10-18-15/h6,9-10,14,18H,3-5,7-8,11H2,1-2H3