1-(6-tert-butylquinazolin-4-yl)-2-[(E)-2-(4-chlorophenyl)ethenyl]hexane-1,6-diamine

Systemtic Name: 1-(6-tert-butylquinazolin-4-yl)-2-[(E)-2-(4-chlorophenyl)ethenyl]hexane-1,6-diamine Openeye Name: 1-(6-tert-butylquinazolin-4-yl)-2-[(E)-2-(4-chlorophenyl)vinyl]hexane-1,6-diamine CAS Name: 1-(6-tert-butyl-4-quinazolinyl)-2-[(E)-2-(4-chlorophenyl)ethenyl]hexane-1,6-diamine IUPAC Name: 1-(6-tert-butylquinazolin-4-yl)-2-[(E)-2-(4-chlorophenyl)ethenyl]hexane-1,6-diamine Traditional Name: [(E)-2-(4-aminobutyl)-1-(6-tert-butylquinazolin-4-yl)-4-(4-chlorophenyl)but-3-enyl]amine Formula: C26H33ClN4 MolecularWeight: 437.02002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)N=CN=C2C(C(CCCCN)C=CC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N=CN=C2C(C(CCCCN)/C=C/C3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C26H33ClN4/c1-26(2,3)20-11-14-23-22(16-20)25(31-17-30-23)24(29)19(6-4-5-15-28)10-7-18-8-12-21(27)13-9-18/h7-14,16-17,19,24H,4-6,15,28-29H2,1-3H3/b10-7+