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

Systemtic Name: 3-[4-(4-azanyl-2-methyl-quinolin-6-yl)-6-methylsulfanyl-1,3,5-triazin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-(4-amino-2-methyl-6-quinolyl)-6-methylsulfanyl-1,3,5-triazin-2-yl]benzamidine CAS Name: 3-[4-(4-amino-2-methyl-6-quinolinyl)-6-(methylthio)-1,3,5-triazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[4-(4-amino-2-methylquinolin-6-yl)-6-methylsulfanyl-1,3,5-triazin-2-yl]benzenecarboximidamide Traditional Name: 3-[4-(4-amino-2-methyl-6-quinolyl)-6-(methylthio)-s-triazin-2-yl]benzamidine Formula: C21H19N7S MolecularWeight: 401.48746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N7S/c1-11-8-16(22)15-10-14(6-7-17(15)25-11)20-26-19(27-21(28-20)29-2)13-5-3-4-12(9-13)18(23)24/h3-10H,1-2H3,(H2,22,25)(H3,23,24)