2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-4-piperidin-1-yl-quinazoline

Systemtic Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-4-piperidin-1-yl-quinazoline Openeye Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-4-(1-piperidyl)quinazoline CAS Name: 2-[1-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]ethyl]-4-(1-piperidinyl)quinazoline IUPAC Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-4-piperidin-1-ylquinazoline Traditional Name: 2-[1-(4-brosylpiperazino)ethyl]-4-piperidino-quinazoline Formula: C25H30BrN5O2S MolecularWeight: 544.507

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)N3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=N1)N3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H30BrN5O2S/c1-19(29-15-17-31(18-16-29)34(32,33)21-11-9-20(26)10-12-21)24-27-23-8-4-3-7-22(23)25(28-24)30-13-5-2-6-14-30/h3-4,7-12,19H,2,5-6,13-18H2,1H3