2-(1-cyclopropylimidazol-2-yl)sulfanylcycloheptan-1-one

Systemtic Name: 2-(1-cyclopropylimidazol-2-yl)sulfanylcycloheptan-1-one Openeye Name: 2-(1-cyclopropylimidazol-2-yl)sulfanylcycloheptanone CAS Name: 2-[(1-cyclopropyl-2-imidazolyl)thio]-1-cycloheptanone IUPAC Name: 2-(1-cyclopropylimidazol-2-yl)sulfanylcycloheptan-1-one Traditional Name: 2-[(1-cyclopropylimidazol-2-yl)thio]cycloheptanone Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)CC1)SC2=NC=CN2C3CC3

Isomeric SMILES

C1CCC(C(=O)CC1)SC2=NC=CN2C3CC3

InChI

InChI=1S/C13H18N2OS/c16-11-4-2-1-3-5-12(11)17-13-14-8-9-15(13)10-6-7-10/h8-10,12H,1-7H2