2-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4-one

Systemtic Name: 2-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4-one Openeye Name: 2-[3-(azepan-1-yl)-3-oxo-propyl]-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4-one CAS Name: 2-[3-(1-azepanyl)-3-oxopropyl]-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-4-quinazolinone IUPAC Name: 2-[3-(azepan-1-yl)-3-oxopropyl]-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]quinazolin-4-one Traditional Name: 2-[3-(azepan-1-yl)-3-keto-propyl]-3-[3-keto-3-(4-phenylpiperazino)propyl]quinazolin-4-one Formula: C30H37N5O3 MolecularWeight: 515.64648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCC2=NC3=CC=CC=C3C(=O)N2CCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)C(=O)CCC2=NC3=CC=CC=C3C(=O)N2CCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H37N5O3/c36-28(33-17-8-1-2-9-18-33)15-14-27-31-26-13-7-6-12-25(26)30(38)35(27)19-16-29(37)34-22-20-32(21-23-34)24-10-4-3-5-11-24/h3-7,10-13H,1-2,8-9,14-23H2