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

Systemtic Name: N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]-4-methyl-N-piperidin-3-yl-benzamide Openeye Name: N-[1-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)propyl]-4-methyl-N-(3-piperidyl)benzamide CAS Name: N-[1-[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl]-4-methyl-N-(3-piperidinyl)benzamide IUPAC Name: N-[1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)propyl]-4-methyl-N-piperidin-3-ylbenzamide Traditional Name: N-[1-(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)propyl]-4-methyl-N-(3-piperidyl)benzamide Formula: C31H33ClN4O2 MolecularWeight: 529.07232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(C4CCCNC4)C(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(C4CCCNC4)C(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C31H33ClN4O2/c1-3-28(36(25-10-7-17-33-19-25)30(37)23-13-11-21(2)12-14-23)29-34-27-18-24(32)15-16-26(27)31(38)35(29)20-22-8-5-4-6-9-22/h4-6,8-9,11-16,18,25,28,33H,3,7,10,17,19-20H2,1-2H3