4-(2-adamantyl)-N-propyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2-adamantyl)-N-propyl-piperazine-1-carbothioamide Openeye Name: 4-(2-adamantyl)-N-propyl-piperazine-1-carbothioamide CAS Name: 4-(2-adamantyl)-N-propyl-1-piperazinecarbothioamide IUPAC Name: 4-(2-adamantyl)-N-propylpiperazine-1-carbothioamide Traditional Name: 4-(2-adamantyl)-N-propyl-piperazine-1-carbothioamide Formula: C18H31N3S MolecularWeight: 321.52384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCN(CC1)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCCNC(=S)N1CCN(CC1)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C18H31N3S/c1-2-3-19-18(22)21-6-4-20(5-7-21)17-15-9-13-8-14(11-15)12-16(17)10-13/h13-17H,2-12H2,1H3,(H,19,22)