6,7-dimethoxy-2-[[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-2-[[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-benzyl-1,4-diazepan-1-yl)methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-benzyl-1,4-diazepan-1-yl)methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[(4-benzyl-1,4-diazepan-1-yl)methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN3CCCN(CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN3CCCN(CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C23H28N4O3/c1-29-20-13-18-19(14-21(20)30-2)24-22(25-23(18)28)16-27-10-6-9-26(11-12-27)15-17-7-4-3-5-8-17/h3-5,7-8,13-14H,6,9-12,15-16H2,1-2H3,(H,24,25,28)