4-[3-[4-(1H-indol-3-yl)piperidin-1-yl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 4-[3-[4-(1H-indol-3-yl)piperidin-1-yl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-[3-[4-(1H-indol-3-yl)-1-piperidyl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-[3-[4-(1H-indol-3-yl)-1-piperidinyl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-[3-[4-(1H-indol-3-yl)piperidin-1-yl]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-[3-[4-(1H-indol-3-yl)piperidino]propyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C26H28N6O MolecularWeight: 440.54012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2N1C3=CC=CC=C3C(=O)N2CCCN4CCC(CC4)C5=CNC6=CC=CC=C65

Isomeric SMILES

CC1=NN=C2N1C3=CC=CC=C3C(=O)N2CCCN4CCC(CC4)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C26H28N6O/c1-18-28-29-26-31(25(33)21-8-3-5-10-24(21)32(18)26)14-6-13-30-15-11-19(12-16-30)22-17-27-23-9-4-2-7-20(22)23/h2-5,7-10,17,19,27H,6,11-16H2,1H3