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

Systemtic Name: N-(oxolan-2-ylmethyl)-4-phenethyl-piperazine-1-carbothioamide Openeye Name: 4-phenethyl-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide CAS Name: N-(2-oxolanylmethyl)-4-phenethyl-1-piperazinecarbothioamide IUPAC Name: N-(oxolan-2-ylmethyl)-4-phenethylpiperazine-1-carbothioamide Traditional Name: 4-phenethyl-N-(tetrahydrofurfuryl)piperazine-1-carbothioamide Formula: C18H27N3OS MolecularWeight: 333.49148

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)N2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

C1CC(OC1)CNC(=S)N2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C18H27N3OS/c23-18(19-15-17-7-4-14-22-17)21-12-10-20(11-13-21)9-8-16-5-2-1-3-6-16/h1-3,5-6,17H,4,7-15H2,(H,19,23)