7-methoxy-4-(1-methylimidazol-2-yl)sulfanyl-2-phenylazanyl-quinoline-3-carbonitrile

Systemtic Name: 7-methoxy-4-(1-methylimidazol-2-yl)sulfanyl-2-phenylazanyl-quinoline-3-carbonitrile Openeye Name: 2-anilino-7-methoxy-4-(1-methylimidazol-2-yl)sulfanyl-quinoline-3-carbonitrile CAS Name: 2-anilino-7-methoxy-4-[(1-methyl-2-imidazolyl)thio]-3-quinolinecarbonitrile IUPAC Name: 2-anilino-7-methoxy-4-(1-methylimidazol-2-yl)sulfanylquinoline-3-carbonitrile Traditional Name: 2-anilino-7-methoxy-4-[(1-methylimidazol-2-yl)thio]quinoline-3-carbonitrile Formula: C21H17N5OS MolecularWeight: 387.45758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C(=NC3=C2C=CC(=C3)OC)NC4=CC=CC=C4)C#N

Isomeric SMILES

CN1C=CN=C1SC2=C(C(=NC3=C2C=CC(=C3)OC)NC4=CC=CC=C4)C#N

InChI

InChI=1S/C21H17N5OS/c1-26-11-10-23-21(26)28-19-16-9-8-15(27-2)12-18(16)25-20(17(19)13-22)24-14-6-4-3-5-7-14/h3-12H,1-2H3,(H,24,25)