1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-propan-1-one

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-propan-1-one Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-propan-1-one CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-3-[(2-thiophen-2-yl-4-quinazolinyl)thio]-1-propanone IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2-thiophen-2-ylquinazolin-4-yl)sulfanylpropan-1-one Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-3-[[2-(2-thienyl)quinazolin-4-yl]thio]propan-1-one Formula: C25H23FN4OS2 MolecularWeight: 478.604723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCSC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCSC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C25H23FN4OS2/c26-18-7-9-19(10-8-18)29-12-14-30(15-13-29)23(31)11-17-33-25-20-4-1-2-5-21(20)27-24(28-25)22-6-3-16-32-22/h1-10,16H,11-15,17H2