6-ethoxy-4-methyl-2-[4-(4-quinazolin-4-ylpiperazin-1-yl)azepan-1-yl]quinazoline

Systemtic Name: 6-ethoxy-4-methyl-2-[4-(4-quinazolin-4-ylpiperazin-1-yl)azepan-1-yl]quinazoline Openeye Name: 6-ethoxy-4-methyl-2-[4-(4-quinazolin-4-ylpiperazin-1-yl)azepan-1-yl]quinazoline CAS Name: 6-ethoxy-4-methyl-2-[4-[4-(4-quinazolinyl)-1-piperazinyl]-1-azepanyl]quinazoline IUPAC Name: 6-ethoxy-4-methyl-2-[4-(4-quinazolin-4-ylpiperazin-1-yl)azepan-1-yl]quinazoline Traditional Name: 6-ethoxy-4-methyl-2-[4-(4-quinazolin-4-ylpiperazino)azepan-1-yl]quinazoline Formula: C29H35N7O MolecularWeight: 497.6345

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCCC(CC3)N4CCN(CC4)C5=NC=NC6=CC=CC=C65

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2C)N3CCCC(CC3)N4CCN(CC4)C5=NC=NC6=CC=CC=C65

InChI

InChI=1S/C29H35N7O/c1-3-37-23-10-11-27-25(19-23)21(2)32-29(33-27)36-13-6-7-22(12-14-36)34-15-17-35(18-16-34)28-24-8-4-5-9-26(24)30-20-31-28/h4-5,8-11,19-20,22H,3,6-7,12-18H2,1-2H3