N,4-dimethyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]quinazolin-4-yl]benzenesulfonamide

Systemtic Name: N,4-dimethyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]quinazolin-4-yl]benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)quinazolin-4-yl]-N,4-dimethyl-benzenesulfonamide CAS Name: N,4-dimethyl-N-[2-[4-(phenylmethyl)-1-piperazinyl]-4-quinazolinyl]benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)quinazolin-4-yl]-N,4-dimethylbenzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)quinazolin-4-yl]-N,4-dimethyl-benzenesulfonamide Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=NC(=NC3=CC=CC=C32)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=NC(=NC3=CC=CC=C32)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H29N5O2S/c1-21-12-14-23(15-13-21)35(33,34)30(2)26-24-10-6-7-11-25(24)28-27(29-26)32-18-16-31(17-19-32)20-22-8-4-3-5-9-22/h3-15H,16-20H2,1-2H3