O-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl] N-(2,3-dihydro-1,4-benzodioxin-6-yl)carbamothioate

Systemtic Name: O-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl] N-(2,3-dihydro-1,4-benzodioxin-6-yl)carbamothioate Openeye Name: O-[3-[4-(1-naphthyl)piperazin-1-yl]propyl] N-(2,3-dihydro-1,4-benzodioxin-6-yl)carbamothioate CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)carbamothioic acid O-[3-[4-(1-naphthalenyl)-1-piperazinyl]propyl] ester IUPAC Name: O-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl] N-(2,3-dihydro-1,4-benzodioxin-6-yl)carbamothioate Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)thiocarbamic acid O-[3-[4-(1-naphthyl)piperazino]propyl] ester Formula: C26H29N3O3S MolecularWeight: 463.59176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC(=S)NC2=CC3=C(C=C2)OCCO3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCCOC(=S)NC2=CC3=C(C=C2)OCCO3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H29N3O3S/c33-26(27-21-9-10-24-25(19-21)31-18-17-30-24)32-16-4-11-28-12-14-29(15-13-28)23-8-3-6-20-5-1-2-7-22(20)23/h1-3,5-10,19H,4,11-18H2,(H,27,33)