7-ethyl-6-oxidanylidene-N-phenyl-1,3,4,8,9,9a-hexahydropyrazino[1,2-c]pyrimidine-2-carbothioamide

Systemtic Name: 7-ethyl-6-oxidanylidene-N-phenyl-1,3,4,8,9,9a-hexahydropyrazino[1,2-c]pyrimidine-2-carbothioamide Openeye Name: 7-ethyl-6-oxo-N-phenyl-1,3,4,8,9,9a-hexahydropyrazino[1,2-c]pyrimidine-2-carbothioamide CAS Name: 7-ethyl-6-oxo-N-phenyl-1,3,4,8,9,9a-hexahydropyrazino[1,2-c]pyrimidine-2-carbothioamide IUPAC Name: 7-ethyl-6-oxo-N-phenyl-1,3,4,8,9,9a-hexahydropyrazino[1,2-c]pyrimidine-2-carbothioamide Traditional Name: 7-ethyl-6-keto-N-phenyl-1,3,4,8,9,9a-hexahydropyrazino[1,2-c]pyrimidine-2-carbothioamide Formula: C16H22N4OS MolecularWeight: 318.43708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2CN(CCN2C1=O)C(=S)NC3=CC=CC=C3

Isomeric SMILES

CCN1CCC2CN(CCN2C1=O)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C16H22N4OS/c1-2-18-9-8-14-12-19(10-11-20(14)16(18)21)15(22)17-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3,(H,17,22)