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

Systemtic Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-3-[furan-2-ylmethyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propan-1-one Openeye Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-3-[2-furylmethyl-[2-(2-thienyl)quinazolin-4-yl]amino]propan-1-one CAS Name: 1-[4-(2-fluorophenyl)-1-piperazinyl]-3-[2-furanylmethyl-(2-thiophen-2-yl-4-quinazolinyl)amino]-1-propanone IUPAC Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-3-[furan-2-ylmethyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propan-1-one Traditional Name: 1-[4-(2-fluorophenyl)piperazino]-3-[2-furfuryl-[2-(2-thienyl)quinazolin-4-yl]amino]propan-1-one Formula: C30H28FN5O2S MolecularWeight: 541.639023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)CCN(CC3=CC=CO3)C4=NC(=NC5=CC=CC=C54)C6=CC=CS6

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)CCN(CC3=CC=CO3)C4=NC(=NC5=CC=CC=C54)C6=CC=CS6

InChI

InChI=1S/C30H28FN5O2S/c31-24-9-2-4-11-26(24)34-15-17-35(18-16-34)28(37)13-14-36(21-22-7-5-19-38-22)30-23-8-1-3-10-25(23)32-29(33-30)27-12-6-20-39-27/h1-12,19-20H,13-18,21H2