5-chloranyl-2-methoxy-N-methyl-N-(2-piperazin-1-ylquinazolin-4-yl)benzenesulfonamide

Systemtic Name: 5-chloranyl-2-methoxy-N-methyl-N-(2-piperazin-1-ylquinazolin-4-yl)benzenesulfonamide Openeye Name: 5-chloro-2-methoxy-N-methyl-N-(2-piperazin-1-ylquinazolin-4-yl)benzenesulfonamide CAS Name: 5-chloro-2-methoxy-N-methyl-N-[2-(1-piperazinyl)-4-quinazolinyl]benzenesulfonamide IUPAC Name: 5-chloro-2-methoxy-N-methyl-N-(2-piperazin-1-ylquinazolin-4-yl)benzenesulfonamide Traditional Name: 5-chloro-2-methoxy-N-methyl-N-(2-piperazinoquinazolin-4-yl)benzenesulfonamide Formula: C20H22ClN5O3S MolecularWeight: 447.93838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=NC2=CC=CC=C21)N3CCNCC3)S(=O)(=O)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CN(C1=NC(=NC2=CC=CC=C21)N3CCNCC3)S(=O)(=O)C4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C20H22ClN5O3S/c1-25(30(27,28)18-13-14(21)7-8-17(18)29-2)19-15-5-3-4-6-16(15)23-20(24-19)26-11-9-22-10-12-26/h3-8,13,22H,9-12H2,1-2H3