1-[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]-1-[6-(2-methylpropylamino)hexyl]-2-phenyl-guanidine

Systemtic Name: 1-[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]-1-[6-(2-methylpropylamino)hexyl]-2-phenyl-guanidine Openeye Name: 1-[6-(isobutylamino)hexyl]-1-[6-methoxy-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-yl]-2-phenyl-guanidine CAS Name: 1-[6-methoxy-2-[(E)-2-(2-pyridinyl)ethenyl]-4-quinazolinyl]-1-[6-(2-methylpropylamino)hexyl]-2-phenylguanidine IUPAC Name: 1-[6-methoxy-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-yl]-1-[6-(2-methylpropylamino)hexyl]-2-phenylguanidine Traditional Name: 1-[6-(isobutylamino)hexyl]-1-[6-methoxy-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-yl]-2-phenyl-guanidine Formula: C33H41N7O MolecularWeight: 551.72494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCCCCCCN(C1=NC(=NC2=C1C=C(C=C2)OC)C=CC3=CC=CC=N3)C(=NC4=CC=CC=C4)N

Isomeric SMILES

CC(C)CNCCCCCCN(C1=NC(=NC2=C1C=C(C=C2)OC)/C=C/C3=CC=CC=N3)C(=NC4=CC=CC=C4)N

InChI

InChI=1S/C33H41N7O/c1-25(2)24-35-20-10-4-5-12-22-40(33(34)37-27-14-7-6-8-15-27)32-29-23-28(41-3)17-18-30(29)38-31(39-32)19-16-26-13-9-11-21-36-26/h6-9,11,13-19,21,23,25,35H,4-5,10,12,20,22,24H2,1-3H3,(H2,34,37)/b19-16+