N-[[3-[4-(diethylamino)quinazolin-6-yl]phenyl]methyl]-N-methyl-isoquinoline-3-carboxamide

Systemtic Name: N-[[3-[4-(diethylamino)quinazolin-6-yl]phenyl]methyl]-N-methyl-isoquinoline-3-carboxamide Openeye Name: N-[[3-[4-(diethylamino)quinazolin-6-yl]phenyl]methyl]-N-methyl-isoquinoline-3-carboxamide CAS Name: N-[[3-[4-(diethylamino)-6-quinazolinyl]phenyl]methyl]-N-methyl-3-isoquinolinecarboxamide IUPAC Name: N-[[3-[4-(diethylamino)quinazolin-6-yl]phenyl]methyl]-N-methylisoquinoline-3-carboxamide Traditional Name: N-[3-[4-(diethylamino)quinazolin-6-yl]benzyl]-N-methyl-isoquinoline-3-carboxamide Formula: C30H29N5O MolecularWeight: 475.58416

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC=NC2=C1C=C(C=C2)C3=CC(=CC=C3)CN(C)C(=O)C4=CC5=CC=CC=C5C=N4

Isomeric SMILES

CCN(CC)C1=NC=NC2=C1C=C(C=C2)C3=CC(=CC=C3)CN(C)C(=O)C4=CC5=CC=CC=C5C=N4

InChI

InChI=1S/C30H29N5O/c1-4-35(5-2)29-26-16-24(13-14-27(26)32-20-33-29)22-12-8-9-21(15-22)19-34(3)30(36)28-17-23-10-6-7-11-25(23)18-31-28/h6-18,20H,4-5,19H2,1-3H3