3-(2-azanylquinazolin-6-yl)-N-[4-[3-(dimethylamino)propoxy]phenyl]-4-methyl-benzamide

Systemtic Name: 3-(2-azanylquinazolin-6-yl)-N-[4-[3-(dimethylamino)propoxy]phenyl]-4-methyl-benzamide Openeye Name: 3-(2-aminoquinazolin-6-yl)-N-[4-[3-(dimethylamino)propoxy]phenyl]-4-methyl-benzamide CAS Name: 3-(2-amino-6-quinazolinyl)-N-[4-[3-(dimethylamino)propoxy]phenyl]-4-methylbenzamide IUPAC Name: 3-(2-aminoquinazolin-6-yl)-N-[4-[3-(dimethylamino)propoxy]phenyl]-4-methylbenzamide Traditional Name: 3-(2-aminoquinazolin-6-yl)-N-[4-[3-(dimethylamino)propoxy]phenyl]-4-methyl-benzamide Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)OCCCN(C)C)C3=CC4=CN=C(N=C4C=C3)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)OCCCN(C)C)C3=CC4=CN=C(N=C4C=C3)N

InChI

InChI=1S/C27H29N5O2/c1-18-5-6-20(16-24(18)19-7-12-25-21(15-19)17-29-27(28)31-25)26(33)30-22-8-10-23(11-9-22)34-14-4-13-32(2)3/h5-12,15-17H,4,13-14H2,1-3H3,(H,30,33)(H2,28,29,31)