2-[2-[[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[[4-(1,3-benzoxazol-2-yl)-1-piperidyl]methyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-[[4-(1,3-benzoxazol-2-yl)piperidino]methyl]-4-keto-quinazolin-3-yl]acetonitrile Formula: C23H21N5O2 MolecularWeight: 399.44514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3O2)CC4=NC5=CC=CC=C5C(=O)N4CC#N

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3O2)CC4=NC5=CC=CC=C5C(=O)N4CC#N

InChI

InChI=1S/C23H21N5O2/c24-11-14-28-21(25-18-6-2-1-5-17(18)23(28)29)15-27-12-9-16(10-13-27)22-26-19-7-3-4-8-20(19)30-22/h1-8,16H,9-10,12-15H2