2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-3-(4-ethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-3-(4-ethoxyphenyl)quinazolin-4-one Openeye Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-3-(4-ethoxyphenyl)quinazolin-4-one CAS Name: 2-[1-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]ethyl]-3-(4-ethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-3-(4-ethoxyphenyl)quinazolin-4-one Traditional Name: 2-[1-(4-brosylpiperazino)ethyl]-3-p-phenetyl-quinazolin-4-one Formula: C28H29BrN4O4S MolecularWeight: 597.52326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C28H29BrN4O4S/c1-3-37-23-12-10-22(11-13-23)33-27(30-26-7-5-4-6-25(26)28(33)34)20(2)31-16-18-32(19-17-31)38(35,36)24-14-8-21(29)9-15-24/h4-15,20H,3,16-19H2,1-2H3