3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]carbonyl-N,N-dimethyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: 3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]carbonyl-N,N-dimethyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbonyl]-N,N-dimethyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: 3-[[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-oxomethyl]-N,N-dimethyl-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: 3-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazine-1-carbonyl]-N,N-dimethyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbonyl]-N,N-dimethyl-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C25H30N6O7S MolecularWeight: 558.6067

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OCC(O2)C(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OCC(O2)C(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC

InChI

InChI=1S/C25H30N6O7S/c1-29(2)39(33,34)15-5-6-18-21(11-15)38-22(14-37-18)24(32)30-7-9-31(10-8-30)25-27-17-13-20(36-4)19(35-3)12-16(17)23(26)28-25/h5-6,11-13,22H,7-10,14H2,1-4H3,(H2,26,27,28)