2-[6-[[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]amino]hexyl]guanidine

Systemtic Name: 2-[6-[[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]amino]hexyl]guanidine Openeye Name: 2-[6-[[6-methoxy-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-yl]amino]hexyl]guanidine CAS Name: 2-[6-[[6-methoxy-2-[(E)-2-(2-pyridinyl)ethenyl]-4-quinazolinyl]amino]hexyl]guanidine IUPAC Name: 2-[6-[[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]amino]hexyl]guanidine Traditional Name: 2-[6-[[6-methoxy-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-yl]amino]hexyl]guanidine Formula: C23H29N7O MolecularWeight: 419.52266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N=C2NCCCCCCN=C(N)N)C=CC3=CC=CC=N3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N=C2NCCCCCCN=C(N)N)/C=C/C3=CC=CC=N3

InChI

InChI=1S/C23H29N7O/c1-31-18-10-11-20-19(16-18)22(27-14-5-2-3-6-15-28-23(24)25)30-21(29-20)12-9-17-8-4-7-13-26-17/h4,7-13,16H,2-3,5-6,14-15H2,1H3,(H4,24,25,28)(H,27,29,30)/b12-9+