(2S)-2-(1-cyclopropylimidazol-2-yl)sulfanyl-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)propan-1-one

Systemtic Name: (2S)-2-(1-cyclopropylimidazol-2-yl)sulfanyl-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)propan-1-one Openeye Name: (2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(1-cyclopropylimidazol-2-yl)sulfanyl-propan-1-one CAS Name: (2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(1-cyclopropyl-2-imidazolyl)thio]-1-propanone IUPAC Name: (2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(1-cyclopropylimidazol-2-yl)sulfanylpropan-1-one Traditional Name: (2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(1-cyclopropylimidazol-2-yl)thio]propan-1-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C(C)SC2=NC=CN2C3CC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)SC2=NC=CN2C3CC3

InChI

InChI=1S/C17H21N3O2S/c1-9-14(11(3)21)10(2)19-15(9)16(22)12(4)23-17-18-7-8-20(17)13-5-6-13/h7-8,12-13,19H,5-6H2,1-4H3/t12-/m0/s1