3-(3-fluorophenyl)-1-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]prop-2-yn-1-one

Systemtic Name: 3-(3-fluorophenyl)-1-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]prop-2-yn-1-one Openeye Name: 3-(3-fluorophenyl)-1-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]prop-2-yn-1-one CAS Name: 3-(3-fluorophenyl)-1-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)-1-piperazinyl]-2-propyn-1-one IUPAC Name: 3-(3-fluorophenyl)-1-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]prop-2-yn-1-one Traditional Name: 3-(3-fluorophenyl)-1-[4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazino]prop-2-yn-1-one Formula: C21H17FN4OS MolecularWeight: 392.449283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NS2)C3=CC=CC=C3)C(=O)C#CC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCN1C2=NC(=NS2)C3=CC=CC=C3)C(=O)C#CC4=CC(=CC=C4)F

InChI

InChI=1S/C21H17FN4OS/c22-18-8-4-5-16(15-18)9-10-19(27)25-11-13-26(14-12-25)21-23-20(24-28-21)17-6-2-1-3-7-17/h1-8,15H,11-14H2