3-[4-[1-(azepan-3-yl)propoxy]phenyl]-5-methoxy-2-methyl-quinazolin-4-one

Systemtic Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-5-methoxy-2-methyl-quinazolin-4-one Openeye Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-5-methoxy-2-methyl-quinazolin-4-one CAS Name: 3-[4-[1-(3-azepanyl)propoxy]phenyl]-5-methoxy-2-methyl-4-quinazolinone IUPAC Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-5-methoxy-2-methylquinazolin-4-one Traditional Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-5-methoxy-2-methyl-quinazolin-4-one Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCCNC1)OC2=CC=C(C=C2)N3C(=NC4=C(C3=O)C(=CC=C4)OC)C

Isomeric SMILES

CCC(C1CCCCNC1)OC2=CC=C(C=C2)N3C(=NC4=C(C3=O)C(=CC=C4)OC)C

InChI

InChI=1S/C25H31N3O3/c1-4-22(18-8-5-6-15-26-16-18)31-20-13-11-19(12-14-20)28-17(2)27-21-9-7-10-23(30-3)24(21)25(28)29/h7,9-14,18,22,26H,4-6,8,15-16H2,1-3H3