1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-[(1-methyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-(1-methylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-[(1-methylimidazol-2-yl)thio]ethanone Formula: C15H19N3OS MolecularWeight: 289.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)CSC2=NC=CN2C

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)CSC2=NC=CN2C

InChI

InChI=1S/C15H19N3OS/c1-5-7-18-11(2)9-13(12(18)3)14(19)10-20-15-16-6-8-17(15)4/h5-6,8-9H,1,7,10H2,2-4H3