N4-[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]cyclohexane-1,4-diamine

Systemtic Name: N4-[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]cyclohexane-1,4-diamine Openeye Name: N4-[6-methoxy-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-yl]cyclohexane-1,4-diamine CAS Name: N4-[6-methoxy-2-[(E)-2-(2-pyridinyl)ethenyl]-4-quinazolinyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-[6-methoxy-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-yl]amine Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N=C2NC3CCC(CC3)N)C=CC4=CC=CC=N4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N=C2NC3CCC(CC3)N)/C=C/C4=CC=CC=N4

InChI

InChI=1S/C22H25N5O/c1-28-18-10-11-20-19(14-18)22(25-17-7-5-15(23)6-8-17)27-21(26-20)12-9-16-4-2-3-13-24-16/h2-4,9-15,17H,5-8,23H2,1H3,(H,25,26,27)/b12-9+