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

Systemtic Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)C2=CC=CN2)C3CCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)C2=CC=CN2)C3CCCC3)C

InChI

InChI=1S/C16H21N3OS/c1-11-12(2)19(13-6-3-4-7-13)16(18-11)21-10-15(20)14-8-5-9-17-14/h5,8-9,13,17H,3-4,6-7,10H2,1-2H3