piperidin-1-yl-[4-[[(2-thiophen-2-ylquinazolin-4-yl)amino]methyl]phenyl]methanone

Systemtic Name: piperidin-1-yl-[4-[[(2-thiophen-2-ylquinazolin-4-yl)amino]methyl]phenyl]methanone Openeye Name: 1-piperidyl-[4-[[[2-(2-thienyl)quinazolin-4-yl]amino]methyl]phenyl]methanone CAS Name: 1-piperidinyl-[4-[[(2-thiophen-2-yl-4-quinazolinyl)amino]methyl]phenyl]methanone IUPAC Name: piperidin-1-yl-[4-[[(2-thiophen-2-ylquinazolin-4-yl)amino]methyl]phenyl]methanone Traditional Name: piperidino-[4-[[[2-(2-thienyl)quinazolin-4-yl]amino]methyl]phenyl]methanone Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C25H24N4OS/c30-25(29-14-4-1-5-15-29)19-12-10-18(11-13-19)17-26-23-20-7-2-3-8-21(20)27-24(28-23)22-9-6-16-31-22/h2-3,6-13,16H,1,4-5,14-15,17H2,(H,26,27,28)