3-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-2-methyl-quinazolin-4-one

Systemtic Name: 3-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-2-methyl-quinazolin-4-one Openeye Name: 3-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxo-propyl]-2-methyl-quinazolin-4-one CAS Name: 3-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-2-methyl-4-quinazolinone IUPAC Name: 3-[3-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-2-methylquinazolin-4-one Traditional Name: 3-[3-keto-3-(4-p-anisyl-1,4-diazepan-1-yl)propyl]-2-methyl-quinazolin-4-one Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)N3CCCN(CC3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)N3CCCN(CC3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H30N4O3/c1-19-26-23-7-4-3-6-22(23)25(31)29(19)15-12-24(30)28-14-5-13-27(16-17-28)18-20-8-10-21(32-2)11-9-20/h3-4,6-11H,5,12-18H2,1-2H3