5-butylsulfonyl-7-methoxy-2-[5-(pyridin-2-ylmethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-1H-quinazolin-4-one

Systemtic Name: 5-butylsulfonyl-7-methoxy-2-[5-(pyridin-2-ylmethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-1H-quinazolin-4-one Openeye Name: 5-butylsulfonyl-7-methoxy-2-[5-(2-pyridylmethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-1H-quinazolin-4-one CAS Name: 5-butylsulfonyl-7-methoxy-2-[5-(2-pyridinylmethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-1H-quinazolin-4-one IUPAC Name: 5-butylsulfonyl-7-methoxy-2-[5-(pyridin-2-ylmethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-1H-quinazolin-4-one Traditional Name: 5-butylsulfonyl-7-methoxy-2-[5-(2-pyridylmethylamino)-3,4-dihydro-1H-2,6-naphthyridin-2-yl]-1H-quinazolin-4-one Formula: C27H30N6O4S MolecularWeight: 534.6299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C2C(=CC(=C1)OC)NC(=NC2=O)N3CCC4=C(C3)C=CN=C4NCC5=CC=CC=N5

Isomeric SMILES

CCCCS(=O)(=O)C1=C2C(=CC(=C1)OC)NC(=NC2=O)N3CCC4=C(C3)C=CN=C4NCC5=CC=CC=N5

InChI

InChI=1S/C27H30N6O4S/c1-3-4-13-38(35,36)23-15-20(37-2)14-22-24(23)26(34)32-27(31-22)33-12-9-21-18(17-33)8-11-29-25(21)30-16-19-7-5-6-10-28-19/h5-8,10-11,14-15H,3-4,9,12-13,16-17H2,1-2H3,(H,29,30)(H,31,32,34)