3-(1-cyclopropylimidazol-2-yl)sulfanylazepan-2-one

Systemtic Name: 3-(1-cyclopropylimidazol-2-yl)sulfanylazepan-2-one Openeye Name: 3-(1-cyclopropylimidazol-2-yl)sulfanylazepan-2-one CAS Name: 3-[(1-cyclopropyl-2-imidazolyl)thio]-2-azepanone IUPAC Name: 3-(1-cyclopropylimidazol-2-yl)sulfanylazepan-2-one Traditional Name: 3-[(1-cyclopropylimidazol-2-yl)thio]azepan-2-one Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=NC=CN2C3CC3

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=NC=CN2C3CC3

InChI

InChI=1S/C12H17N3OS/c16-11-10(3-1-2-6-13-11)17-12-14-7-8-15(12)9-4-5-9/h7-10H,1-6H2,(H,13,16)