2-chloranyl-N-[[3-(4-phenylazanylquinazolin-6-yl)phenyl]methyl]-N-propyl-benzamide

Systemtic Name: 2-chloranyl-N-[[3-(4-phenylazanylquinazolin-6-yl)phenyl]methyl]-N-propyl-benzamide Openeye Name: N-[[3-(4-anilinoquinazolin-6-yl)phenyl]methyl]-2-chloro-N-propyl-benzamide CAS Name: N-[[3-(4-anilino-6-quinazolinyl)phenyl]methyl]-2-chloro-N-propylbenzamide IUPAC Name: N-[[3-(4-anilinoquinazolin-6-yl)phenyl]methyl]-2-chloro-N-propylbenzamide Traditional Name: N-[3-(4-anilinoquinazolin-6-yl)benzyl]-2-chloro-N-propyl-benzamide Formula: C31H27ClN4O MolecularWeight: 507.02528

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC(=C1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=CC=C4)C(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCCN(CC1=CC=CC(=C1)C2=CC3=C(C=C2)N=CN=C3NC4=CC=CC=C4)C(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C31H27ClN4O/c1-2-17-36(31(37)26-13-6-7-14-28(26)32)20-22-9-8-10-23(18-22)24-15-16-29-27(19-24)30(34-21-33-29)35-25-11-4-3-5-12-25/h3-16,18-19,21H,2,17,20H2,1H3,(H,33,34,35)