N-[[(2R)-oxolan-2-yl]methyl]-4-(phenylmethyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[[(2R)-oxolan-2-yl]methyl]-4-(phenylmethyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: 4-benzylsulfonyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazine-1-carbothioamide CAS Name: N-[[(2R)-2-oxolanyl]methyl]-4-(phenylmethyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: 4-benzylsulfonyl-N-[[(2R)-oxolan-2-yl]methyl]piperazine-1-carbothioamide Traditional Name: 4-benzylsulfonyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazine-1-carbothioamide Formula: C17H25N3O3S2 MolecularWeight: 383.5287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](OC1)CNC(=S)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H25N3O3S2/c21-25(22,14-15-5-2-1-3-6-15)20-10-8-19(9-11-20)17(24)18-13-16-7-4-12-23-16/h1-3,5-6,16H,4,7-14H2,(H,18,24)/t16-/m1/s1