4-butan-2-yl-N-ethyl-3-oxidanylidene-2-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: 4-butan-2-yl-N-ethyl-3-oxidanylidene-2-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 2-benzyl-N-ethyl-3-oxo-4-sec-butyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: 4-butan-2-yl-N-ethyl-3-oxo-2-(phenylmethyl)-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 2-benzyl-4-butan-2-yl-N-ethyl-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 2-benzyl-N-ethyl-3-keto-4-sec-butyl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C21H32N4OS MolecularWeight: 388.56998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(NC12CCN(CC2)C(=S)NCC)CC3=CC=CC=C3

Isomeric SMILES

CCC(C)N1C(=O)C(NC12CCN(CC2)C(=S)NCC)CC3=CC=CC=C3

InChI

InChI=1S/C21H32N4OS/c1-4-16(3)25-19(26)18(15-17-9-7-6-8-10-17)23-21(25)11-13-24(14-12-21)20(27)22-5-2/h6-10,16,18,23H,4-5,11-15H2,1-3H3,(H,22,27)