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

Systemtic Name: N-(3-methylphenyl)-3-oxidanylidene-2-(phenylmethyl)-4-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 2-benzyl-N-(m-tolyl)-3-oxo-4-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3-methylphenyl)-3-oxo-2-(phenylmethyl)-4-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 2-benzyl-N-(3-methylphenyl)-3-oxo-4-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 2-benzyl-3-keto-N-(m-tolyl)-4-propyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C25H32N4OS MolecularWeight: 436.61278

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(NC12CCN(CC2)C(=S)NC3=CC=CC(=C3)C)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C(NC12CCN(CC2)C(=S)NC3=CC=CC(=C3)C)CC4=CC=CC=C4

InChI

InChI=1S/C25H32N4OS/c1-3-14-29-23(30)22(18-20-9-5-4-6-10-20)27-25(29)12-15-28(16-13-25)24(31)26-21-11-7-8-19(2)17-21/h4-11,17,22,27H,3,12-16,18H2,1-2H3,(H,26,31)