N-(3-azanylpropyl)-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]-4-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]-4-methyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)propyl]-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl]-4-methylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)propyl]-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)propyl]-4-methyl-benzamide Formula: C29H31ClN4O2 MolecularWeight: 503.03504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H31ClN4O2/c1-3-26(33(17-7-16-31)28(35)22-12-10-20(2)11-13-22)27-32-25-18-23(30)14-15-24(25)29(36)34(27)19-21-8-5-4-6-9-21/h4-6,8-15,18,26H,3,7,16-17,19,31H2,1-2H3