N-[1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]methanesulfonamide

Systemtic Name: N-[1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]methanesulfonamide Openeye Name: N-[1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbonyl]propyl]methanesulfonamide CAS Name: N-[1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-1-oxobutan-2-yl]methanesulfonamide IUPAC Name: N-[1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-1-oxobutan-2-yl]methanesulfonamide Traditional Name: N-[1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazine-1-carbonyl]propyl]methanesulfonamide Formula: C19H28N6O5S MolecularWeight: 452.52782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)NS(=O)(=O)C

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)NS(=O)(=O)C

InChI

InChI=1S/C19H28N6O5S/c1-5-13(23-31(4,27)28)18(26)24-6-8-25(9-7-24)19-21-14-11-16(30-3)15(29-2)10-12(14)17(20)22-19/h10-11,13,23H,5-9H2,1-4H3,(H2,20,21,22)