4-azanyl-1-[(3-bromophenyl)methyl]-5-(piperidin-1-ylmethyl)pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(3-bromophenyl)methyl]-5-(piperidin-1-ylmethyl)pyrimidin-2-one Openeye Name: 4-amino-1-[(3-bromophenyl)methyl]-5-(1-piperidylmethyl)pyrimidin-2-one CAS Name: 4-amino-1-[(3-bromophenyl)methyl]-5-(1-piperidinylmethyl)-2-pyrimidinone IUPAC Name: 4-amino-1-[(3-bromophenyl)methyl]-5-(piperidin-1-ylmethyl)pyrimidin-2-one Traditional Name: 4-amino-1-(3-bromobenzyl)-5-(piperidinomethyl)pyrimidin-2-one Formula: C17H21BrN4O MolecularWeight: 377.27884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CN(C(=O)N=C2N)CC3=CC(=CC=C3)Br

Isomeric SMILES

C1CCN(CC1)CC2=CN(C(=O)N=C2N)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H21BrN4O/c18-15-6-4-5-13(9-15)10-22-12-14(16(19)20-17(22)23)11-21-7-2-1-3-8-21/h4-6,9,12H,1-3,7-8,10-11H2,(H2,19,20,23)