4-[3-[4-(diphenylmethyl)-1,4-diazepan-1-yl]propylamino]-1-methyl-quinazolin-2-one

Systemtic Name: 4-[3-[4-(diphenylmethyl)-1,4-diazepan-1-yl]propylamino]-1-methyl-quinazolin-2-one Openeye Name: 4-[3-(4-benzhydryl-1,4-diazepan-1-yl)propylamino]-1-methyl-quinazolin-2-one CAS Name: 4-[3-[4-(diphenylmethyl)-1,4-diazepan-1-yl]propylamino]-1-methyl-2-quinazolinone IUPAC Name: 4-[3-(4-benzhydryl-1,4-diazepan-1-yl)propylamino]-1-methylquinazolin-2-one Traditional Name: 4-[3-(4-benzhydryl-1,4-diazepan-1-yl)propylamino]-1-methyl-quinazolin-2-one Formula: C30H35N5O MolecularWeight: 481.6318

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC1=O)NCCCN3CCCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC1=O)NCCCN3CCCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H35N5O/c1-33-27-17-9-8-16-26(27)29(32-30(33)36)31-18-10-19-34-20-11-21-35(23-22-34)28(24-12-4-2-5-13-24)25-14-6-3-7-15-25/h2-9,12-17,28H,10-11,18-23H2,1H3,(H,31,32,36)