2-[2-[[4-(4-ethylphenyl)carbonylpiperazin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[4-(4-ethylphenyl)carbonylpiperazin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[[4-(4-ethylbenzoyl)piperazin-1-yl]methyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[4-(4-ethylbenzoyl)piperazin-1-yl]methyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-[[4-(4-ethylbenzoyl)piperazino]methyl]-4-keto-quinazolin-3-yl]acetonitrile Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=O)N3CC#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=O)N3CC#N

InChI

InChI=1S/C24H25N5O2/c1-2-18-7-9-19(10-8-18)23(30)28-15-13-27(14-16-28)17-22-26-21-6-4-3-5-20(21)24(31)29(22)12-11-25/h3-10H,2,12-17H2,1H3