1,3-benzodioxol-5-yl-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[[5-(3-fluorophenyl)-2-thienyl]methyl]piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[[5-(3-fluorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-[[5-(3-fluorophenyl)-2-thienyl]methyl]piperazino]methanone Formula: C23H21FN2O3S MolecularWeight: 424.487843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)F)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)F)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H21FN2O3S/c24-18-3-1-2-16(12-18)22-7-5-19(30-22)14-25-8-10-26(11-9-25)23(27)17-4-6-20-21(13-17)29-15-28-20/h1-7,12-13H,8-11,14-15H2