2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-piperidin-1-ylpropyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-piperidin-1-ylpropyl)quinazolin-4-one Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-3-[3-(1-piperidyl)propyl]quinazolin-4-one CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-3-[3-(1-piperidinyl)propyl]-4-quinazolinone IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-(3-piperidin-1-ylpropyl)quinazolin-4-one Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-3-(3-piperidinopropyl)quinazolin-4-one Formula: C24H26BrN3O2S MolecularWeight: 500.45114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(CC1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H26BrN3O2S/c25-19-11-9-18(10-12-19)22(29)17-31-24-26-21-8-3-2-7-20(21)23(30)28(24)16-6-15-27-13-4-1-5-14-27/h2-3,7-12H,1,4-6,13-17H2