N4-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]quinazoline-4,6-diamine

Systemtic Name: N4-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]quinazoline-4,6-diamine Openeye Name: N4-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]quinazoline-4,6-diamine CAS Name: N4-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]quinazoline-4,6-diamine Traditional Name: 4-[6-amino-4-(3-bromoanilino)quinazolin-7-yl]oxybutyl-dimethyl-amine Formula: C20H24BrN5O MolecularWeight: 430.34146

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)N

Isomeric SMILES

CN(C)CCCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)N

InChI

InChI=1S/C20H24BrN5O/c1-26(2)8-3-4-9-27-19-12-18-16(11-17(19)22)20(24-13-23-18)25-15-7-5-6-14(21)10-15/h5-7,10-13H,3-4,8-9,22H2,1-2H3,(H,23,24,25)