3-[4-[1-(azepan-3-yl)propoxy]phenyl]-6-methoxy-2-methyl-quinazolin-4-one

Systemtic Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-6-methoxy-2-methyl-quinazolin-4-one Openeye Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-6-methoxy-2-methyl-quinazolin-4-one CAS Name: 3-[4-[1-(3-azepanyl)propoxy]phenyl]-6-methoxy-2-methyl-4-quinazolinone IUPAC Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-6-methoxy-2-methylquinazolin-4-one Traditional Name: 3-[4-[1-(azepan-3-yl)propoxy]phenyl]-6-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=C(C=C4)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O3/c1-4-24(18-7-5-6-14-26-16-18)31-20-10-8-19(9-11-20)28-17(2)27-23-13-12-21(30-3)15-22(23)25(28)29/h8-13,15,18,24,26H,4-7,14,16H2,1-3H3