2-[2-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-yl]methyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[[4-(2-morpholino-2-oxo-ethyl)piperazin-1-yl]methyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazinyl]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]methyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[4-keto-2-[[4-(2-keto-2-morpholino-ethyl)piperazino]methyl]quinazolin-3-yl]acetonitrile Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=O)N2CC#N)CC(=O)N4CCOCC4

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=O)N2CC#N)CC(=O)N4CCOCC4

InChI

InChI=1S/C21H26N6O3/c22-5-6-27-19(23-18-4-2-1-3-17(18)21(27)29)15-24-7-9-25(10-8-24)16-20(28)26-11-13-30-14-12-26/h1-4H,6-16H2