2-[2-(4-methylpiperazin-1-yl)quinazolin-4-yl]-1,1-bis(oxidanidyl)-3H-1,2-benzothiazole

Systemtic Name: 2-[2-(4-methylpiperazin-1-yl)quinazolin-4-yl]-1,1-bis(oxidanidyl)-3H-1,2-benzothiazole Openeye Name: 2-[2-(4-methylpiperazin-1-yl)quinazolin-4-yl]-1,1-dioxido-3H-1,2-benzothiazole CAS Name: 2-[2-(4-methyl-1-piperazinyl)-4-quinazolinyl]-1,1-dioxido-3H-1,2-benzothiazole IUPAC Name: 2-[2-(4-methylpiperazin-1-yl)quinazolin-4-yl]-1,1-dioxido-3H-1,2-benzothiazole Traditional Name: 2-[2-(4-methylpiperazino)quinazolin-4-yl]-1,1-dioxido-3H-1,2-benzothiazole Formula: C20H21N5O2S-2 MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)N4CC5=CC=CC=C5S4([O-])[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)N4CC5=CC=CC=C5S4([O-])[O-]

InChI

InChI=1S/C20H23N5O2S/c1-23-10-12-24(13-11-23)20-21-17-8-4-3-7-16(17)19(22-20)25-14-15-6-2-5-9-18(15)28(25,26)27/h2-9,26-27H,10-14H2,1H3/p-2