7-azanyl-4-(phenylmethyl)-1-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 7-azanyl-4-(phenylmethyl)-1-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 7-amino-4-benzyl-1-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 7-amino-4-(phenylmethyl)-1-(1-pyrrolidinyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 7-amino-4-benzyl-1-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 7-amino-4-benzyl-1-pyrrolidino-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C20H20N6O MolecularWeight: 360.4124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C3N2C4=C(C=C(C=C4)N)C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=NN=C3N2C4=C(C=C(C=C4)N)C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C20H20N6O/c21-15-8-9-17-16(12-15)18(27)25(13-14-6-2-1-3-7-14)20-23-22-19(26(17)20)24-10-4-5-11-24/h1-3,6-9,12H,4-5,10-11,13,21H2