N-[3-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-4-chloranyl-benzamide

Systemtic Name: N-[3-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-4-chloranyl-benzamide Openeye Name: N-[3-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-3-oxo-propyl]-4-chloro-benzamide CAS Name: N-[3-[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-3-oxopropyl]-4-chlorobenzamide IUPAC Name: N-[3-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-3-oxopropyl]-4-chlorobenzamide Traditional Name: N-[3-[4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-3-keto-propyl]-4-chloro-benzamide Formula: C23H25ClN6O2 MolecularWeight: 452.9366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)CCNC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)CCNC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H25ClN6O2/c24-17-7-5-16(6-8-17)23(32)26-10-9-21(31)30-13-11-29(12-14-30)15-20-27-19-4-2-1-3-18(19)22(25)28-20/h1-8H,9-15H2,(H,26,32)(H2,25,27,28)