tert-butyl 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)quinazolin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)quinazolin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)quinazolin-2-yl]piperazine-1-carboxylate CAS Name: 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)-2-quinazolinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)quinazolin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonylamino)quinazolin-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H32N6O4S MolecularWeight: 524.63508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NS(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NS(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H32N6O4S/c1-26(2,3)36-25(33)31-16-14-30(15-17-31)24-27-22-11-7-6-10-21(22)23(28-24)29-37(34,35)32-13-12-19-8-4-5-9-20(19)18-32/h4-11H,12-18H2,1-3H3,(H,27,28,29)