methyl N-(3,3-dimethylbutan-2-yl)-4-(1H-imidazol-5-yl)piperidine-1-carboximidothioate

Systemtic Name: methyl N-(3,3-dimethylbutan-2-yl)-4-(1H-imidazol-5-yl)piperidine-1-carboximidothioate Openeye Name: methyl 4-(1H-imidazol-5-yl)-N-(1,2,2-trimethylpropyl)piperidine-1-carboximidothioate CAS Name: N-(3,3-dimethylbutan-2-yl)-4-(1H-imidazol-5-yl)-1-piperidinecarboximidothioic acid methyl ester IUPAC Name: methyl N-(3,3-dimethylbutan-2-yl)-4-(1H-imidazol-5-yl)piperidine-1-carboximidothioate Traditional Name: 4-(1H-imidazol-5-yl)-N-(1,2,2-trimethylpropyl)piperidine-1-carboximidothioic acid methyl ester Formula: C16H28N4S MolecularWeight: 308.48532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)N=C(N1CCC(CC1)C2=CN=CN2)SC

Isomeric SMILES

CC(C(C)(C)C)N=C(N1CCC(CC1)C2=CN=CN2)SC

InChI

InChI=1S/C16H28N4S/c1-12(16(2,3)4)19-15(21-5)20-8-6-13(7-9-20)14-10-17-11-18-14/h10-13H,6-9H2,1-5H3,(H,17,18)