2-methyl-N6-[4-(1-methylpiperidin-4-yl)oxy-6-methylsulfanyl-1,3,5-triazin-2-yl]quinoline-4,6-diamine

Systemtic Name: 2-methyl-N6-[4-(1-methylpiperidin-4-yl)oxy-6-methylsulfanyl-1,3,5-triazin-2-yl]quinoline-4,6-diamine Openeye Name: 2-methyl-N6-[4-[(1-methyl-4-piperidyl)oxy]-6-methylsulfanyl-1,3,5-triazin-2-yl]quinoline-4,6-diamine CAS Name: 2-methyl-N6-[4-[(1-methyl-4-piperidinyl)oxy]-6-(methylthio)-1,3,5-triazin-2-yl]quinoline-4,6-diamine IUPAC Name: 2-methyl-6-N-[4-(1-methylpiperidin-4-yl)oxy-6-methylsulfanyl-1,3,5-triazin-2-yl]quinoline-4,6-diamine Traditional Name: (4-amino-2-methyl-6-quinolyl)-[4-[(1-methyl-4-piperidyl)oxy]-6-(methylthio)-s-triazin-2-yl]amine Formula: C20H25N7OS MolecularWeight: 411.5238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=N3)SC)OC4CCN(CC4)C)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=N3)SC)OC4CCN(CC4)C)C(=C1)N

InChI

InChI=1S/C20H25N7OS/c1-12-10-16(21)15-11-13(4-5-17(15)22-12)23-18-24-19(26-20(25-18)29-3)28-14-6-8-27(2)9-7-14/h4-5,10-11,14H,6-9H2,1-3H3,(H2,21,22)(H,23,24,25,26)