N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-[4-(phenylmethyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-(1,1-dioxothiolan-3-yl)-N-methyl-acetamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-2-[4-(phenylmethyl)-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-(1,1-dioxothiolan-3-yl)-N-methylacetamide Traditional Name: 2-(4-benzylpiperazino)-N-(1,1-diketothiolan-3-yl)-N-methyl-acetamide Formula: C18H27N3O3S MolecularWeight: 365.49028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=O)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H27N3O3S/c1-19(17-7-12-25(23,24)15-17)18(22)14-21-10-8-20(9-11-21)13-16-5-3-2-4-6-16/h2-6,17H,7-15H2,1H3