6-(2-morpholin-4-ylethylamino)-4-[[4-(phenylsulfonyl)phenyl]amino]-1,7-naphthyridine-3-carbonitrile

Systemtic Name: 6-(2-morpholin-4-ylethylamino)-4-[[4-(phenylsulfonyl)phenyl]amino]-1,7-naphthyridine-3-carbonitrile Openeye Name: 4-[4-(benzenesulfonyl)anilino]-6-(2-morpholinoethylamino)-1,7-naphthyridine-3-carbonitrile CAS Name: 4-[4-(benzenesulfonyl)anilino]-6-[2-(4-morpholinyl)ethylamino]-1,7-naphthyridine-3-carbonitrile IUPAC Name: 4-[4-(benzenesulfonyl)anilino]-6-(2-morpholin-4-ylethylamino)-1,7-naphthyridine-3-carbonitrile Traditional Name: 4-(4-besylanilino)-6-(2-morpholinoethylamino)-1,7-naphthyridine-3-carbonitrile Formula: C27H26N6O3S MolecularWeight: 514.59874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC=C(C=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1CCNC2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC=C(C=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H26N6O3S/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-36-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)37(34,35)22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32)