4-(diphenylmethyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(diphenylmethyl)-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-benzhydryl-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide CAS Name: 4-(diphenylmethyl)-N-(2-oxolanylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzhydryl-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-benzhydryl-N-(tetrahydrofurfuryl)piperazine-1-carbothioamide Formula: C23H29N3OS MolecularWeight: 395.56086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N3OS/c28-23(24-18-21-12-7-17-27-21)26-15-13-25(14-16-26)22(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-6,8-11,21-22H,7,12-18H2,(H,24,28)