4-[4-(4-azanyl-2-methyl-quinolin-6-yl)-6-methylsulfanyl-1,3,5-triazin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(4-azanyl-2-methyl-quinolin-6-yl)-6-methylsulfanyl-1,3,5-triazin-2-yl]benzenecarbonitrile Openeye Name: 4-[4-(4-amino-2-methyl-6-quinolyl)-6-methylsulfanyl-1,3,5-triazin-2-yl]benzonitrile CAS Name: 4-[4-(4-amino-2-methyl-6-quinolinyl)-6-(methylthio)-1,3,5-triazin-2-yl]benzonitrile IUPAC Name: 4-[4-(4-amino-2-methylquinolin-6-yl)-6-methylsulfanyl-1,3,5-triazin-2-yl]benzonitrile Traditional Name: 4-[4-(4-amino-2-methyl-6-quinolyl)-6-(methylthio)-s-triazin-2-yl]benzonitrile Formula: C21H16N6S MolecularWeight: 384.45694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C3=NC(=NC(=N3)C4=CC=C(C=C4)C#N)SC)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C3=NC(=NC(=N3)C4=CC=C(C=C4)C#N)SC)C(=C1)N

InChI

InChI=1S/C21H16N6S/c1-12-9-17(23)16-10-15(7-8-18(16)24-12)20-25-19(26-21(27-20)28-2)14-5-3-13(11-22)4-6-14/h3-10H,1-2H3,(H2,23,24)