3-[[2-(aminomethyl)phenyl]methyl]-2-[(3R)-3-azanylpiperidin-1-yl]quinazolin-4-one

Systemtic Name: 3-[[2-(aminomethyl)phenyl]methyl]-2-[(3R)-3-azanylpiperidin-1-yl]quinazolin-4-one Openeye Name: 3-[[2-(aminomethyl)phenyl]methyl]-2-[(3R)-3-amino-1-piperidyl]quinazolin-4-one CAS Name: 3-[[2-(aminomethyl)phenyl]methyl]-2-[(3R)-3-amino-1-piperidinyl]-4-quinazolinone IUPAC Name: 3-[[2-(aminomethyl)phenyl]methyl]-2-[(3R)-3-aminopiperidin-1-yl]quinazolin-4-one Traditional Name: 3-[2-(aminomethyl)benzyl]-2-[(3R)-3-aminopiperidino]quinazolin-4-one Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4CN)N

Isomeric SMILES

C1C[C@H](CN(C1)C2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4CN)N

InChI

InChI=1S/C21H25N5O/c22-12-15-6-1-2-7-16(15)13-26-20(27)18-9-3-4-10-19(18)24-21(26)25-11-5-8-17(23)14-25/h1-4,6-7,9-10,17H,5,8,11-14,22-23H2/t17-/m1/s1