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

Systemtic Name: 6-(2-morpholin-4-ylethylamino)-4-[(4-phenylsulfanylphenyl)amino]-1,7-naphthyridine-3-carbonitrile Openeye Name: 6-(2-morpholinoethylamino)-4-(4-phenylsulfanylanilino)-1,7-naphthyridine-3-carbonitrile CAS Name: 6-[2-(4-morpholinyl)ethylamino]-4-[4-(phenylthio)anilino]-1,7-naphthyridine-3-carbonitrile IUPAC Name: 6-(2-morpholin-4-ylethylamino)-4-(4-phenylsulfanylanilino)-1,7-naphthyridine-3-carbonitrile Traditional Name: 6-(2-morpholinoethylamino)-4-[4-(phenylthio)anilino]-1,7-naphthyridine-3-carbonitrile Formula: C27H26N6OS MolecularWeight: 482.59994

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC=C(C=C4)SC5=CC=CC=C5

Isomeric SMILES

C1COCCN1CCNC2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC=C(C=C4)SC5=CC=CC=C5

InChI

InChI=1S/C27H26N6OS/c28-17-20-18-30-25-19-31-26(29-10-11-33-12-14-34-15-13-33)16-24(25)27(20)32-21-6-8-23(9-7-21)35-22-4-2-1-3-5-22/h1-9,16,18-19H,10-15H2,(H,29,31)(H,30,32)