4-methyl-N-[4-oxidanylidene-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-quinazolin-3-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-oxidanylidene-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-quinazolin-3-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[4-oxo-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-quinazolin-3-yl]benzenesulfonamide CAS Name: 4-methyl-N-[4-oxo-2-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-3-quinazolinyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[4-oxo-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylquinazolin-3-yl]benzenesulfonamide Traditional Name: N-[4-keto-2-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]quinazolin-3-yl]-4-methyl-benzenesulfonamide Formula: C27H27N5O4S2 MolecularWeight: 549.66438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O4S2/c1-20-11-13-22(14-12-20)38(35,36)29-32-26(34)23-9-5-6-10-24(23)28-27(32)37-19-25(33)31-17-15-30(16-18-31)21-7-3-2-4-8-21/h2-14,29H,15-19H2,1H3