N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-[4-(1-naphthylmethyl)piperazin-1-yl]propanamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-[4-(1-naphthalenylmethyl)-1-piperazinyl]propanamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]propanamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-[4-(1-naphthylmethyl)piperazino]propionamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCS(=O)(=O)C1)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)NC1CCS(=O)(=O)C1)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H29N3O3S/c1-17(22(26)23-20-9-14-29(27,28)16-20)25-12-10-24(11-13-25)15-19-7-4-6-18-5-2-3-8-21(18)19/h2-8,17,20H,9-16H2,1H3,(H,23,26)