N-(3-methylphenyl)-4-(2-methylpropyl)-3-oxidanylidene-1,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(3-methylphenyl)-4-(2-methylpropyl)-3-oxidanylidene-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 4-isobutyl-N-(m-tolyl)-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3-methylphenyl)-4-(2-methylpropyl)-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3-methylphenyl)-4-(2-methylpropyl)-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 4-isobutyl-3-keto-N-(m-tolyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C19H28N4OS MolecularWeight: 360.51682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N2CCC3(CC2)NCC(=O)N3CC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N2CCC3(CC2)NCC(=O)N3CC(C)C

InChI

InChI=1S/C19H28N4OS/c1-14(2)13-23-17(24)12-20-19(23)7-9-22(10-8-19)18(25)21-16-6-4-5-15(3)11-16/h4-6,11,14,20H,7-10,12-13H2,1-3H3,(H,21,25)