[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(3-pyrrol-1-ylphenyl)methanone

Systemtic Name: [4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(3-pyrrol-1-ylphenyl)methanone Openeye Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-pyrrol-1-ylphenyl)methanone CAS Name: [4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-[3-(1-pyrrolyl)phenyl]methanone IUPAC Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(3-pyrrol-1-ylphenyl)methanone Traditional Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-(3-pyrrol-1-ylphenyl)methanone Formula: C24H24N6O MolecularWeight: 412.48696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)C4=CC(=CC=C4)N5C=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)C4=CC(=CC=C4)N5C=CC=C5

InChI

InChI=1S/C24H24N6O/c25-23-20-8-1-2-9-21(20)26-22(27-23)17-28-12-14-30(15-13-28)24(31)18-6-5-7-19(16-18)29-10-3-4-11-29/h1-11,16H,12-15,17H2,(H2,25,26,27)