N1-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-methoxy-quinazolin-4-yl]-2-methyl-cyclohexane-1,4-diamine

Systemtic Name: N1-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-methoxy-quinazolin-4-yl]-2-methyl-cyclohexane-1,4-diamine Openeye Name: N1-[2-[(E)-2-(4-chlorophenyl)vinyl]-6-methoxy-quinazolin-4-yl]-2-methyl-cyclohexane-1,4-diamine CAS Name: N1-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-methoxy-4-quinazolinyl]-2-methylcyclohexane-1,4-diamine IUPAC Name: 1-N-[2-[(E)-2-(4-chlorophenyl)ethenyl]-6-methoxyquinazolin-4-yl]-2-methylcyclohexane-1,4-diamine Traditional Name: (4-amino-2-methyl-cyclohexyl)-[2-[(E)-2-(4-chlorophenyl)vinyl]-6-methoxy-quinazolin-4-yl]amine Formula: C24H27ClN4O MolecularWeight: 422.95038

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCC1NC2=NC(=NC3=C2C=C(C=C3)OC)C=CC4=CC=C(C=C4)Cl)N

Isomeric SMILES

CC1CC(CCC1NC2=NC(=NC3=C2C=C(C=C3)OC)/C=C/C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C24H27ClN4O/c1-15-13-18(26)8-10-21(15)28-24-20-14-19(30-2)9-11-22(20)27-23(29-24)12-5-16-3-6-17(25)7-4-16/h3-7,9,11-12,14-15,18,21H,8,10,13,26H2,1-2H3,(H,27,28,29)/b12-5+