3-[(2-piperazin-1-ylcarbonyl-[1,3]thiazolo[4,5-h]quinazolin-8-yl)amino]benzenesulfonamide

Systemtic Name: 3-[(2-piperazin-1-ylcarbonyl-[1,3]thiazolo[4,5-h]quinazolin-8-yl)amino]benzenesulfonamide Openeye Name: 3-[[2-(piperazine-1-carbonyl)thiazolo[4,5-h]quinazolin-8-yl]amino]benzenesulfonamide CAS Name: 3-[[2-[oxo(1-piperazinyl)methyl]-8-thiazolo[4,5-h]quinazolinyl]amino]benzenesulfonamide IUPAC Name: 3-[[2-(piperazine-1-carbonyl)-[1,3]thiazolo[4,5-h]quinazolin-8-yl]amino]benzenesulfonamide Traditional Name: 3-[[2-(piperazine-1-carbonyl)thiazolo[4,5-h]quinazolin-8-yl]amino]benzenesulfonamide Formula: C20H19N7O3S2 MolecularWeight: 469.53996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=NC3=C(S2)C4=NC(=NC=C4C=C3)NC5=CC(=CC=C5)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1)C(=O)C2=NC3=C(S2)C4=NC(=NC=C4C=C3)NC5=CC(=CC=C5)S(=O)(=O)N

InChI

InChI=1S/C20H19N7O3S2/c21-32(29,30)14-3-1-2-13(10-14)24-20-23-11-12-4-5-15-17(16(12)26-20)31-18(25-15)19(28)27-8-6-22-7-9-27/h1-5,10-11,22H,6-9H2,(H2,21,29,30)(H,23,24,26)