N-[2-benzamido-6-[[(3,4-dichlorophenyl)-propyl-amino]methyl]quinazolin-4-yl]benzamide

Systemtic Name: N-[2-benzamido-6-[[(3,4-dichlorophenyl)-propyl-amino]methyl]quinazolin-4-yl]benzamide Openeye Name: N-[2-benzamido-6-[(3,4-dichloro-N-propyl-anilino)methyl]quinazolin-4-yl]benzamide CAS Name: N-[2-benzamido-6-[(3,4-dichloro-N-propylanilino)methyl]-4-quinazolinyl]benzamide IUPAC Name: N-[2-benzamido-6-[(3,4-dichloro-N-propylanilino)methyl]quinazolin-4-yl]benzamide Traditional Name: N-[2-benzamido-6-[(3,4-dichloro-N-propyl-anilino)methyl]quinazolin-4-yl]benzamide Formula: C32H27Cl2N5O2 MolecularWeight: 584.49508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC2=C(C=C1)N=C(N=C2NC(=O)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

CCCN(CC1=CC2=C(C=C1)N=C(N=C2NC(=O)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C32H27Cl2N5O2/c1-2-17-39(24-14-15-26(33)27(34)19-24)20-21-13-16-28-25(18-21)29(36-30(40)22-9-5-3-6-10-22)37-32(35-28)38-31(41)23-11-7-4-8-12-23/h3-16,18-19H,2,17,20H2,1H3,(H2,35,36,37,38,40,41)