4-[(3-methylquinoxalin-2-yl)sulfanylmethyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine

Systemtic Name: 4-[(3-methylquinoxalin-2-yl)sulfanylmethyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine Openeye Name: 4-[(3-methylquinoxalin-2-yl)sulfanylmethyl]-6-(1-piperidyl)-1,3,5-triazin-2-amine CAS Name: 4-[[(3-methyl-2-quinoxalinyl)thio]methyl]-6-(1-piperidinyl)-1,3,5-triazin-2-amine IUPAC Name: 4-[(3-methylquinoxalin-2-yl)sulfanylmethyl]-6-piperidin-1-yl-1,3,5-triazin-2-amine Traditional Name: [4-[[(3-methylquinoxalin-2-yl)thio]methyl]-6-piperidino-s-triazin-2-yl]amine Formula: C18H21N7S MolecularWeight: 367.47124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1SCC3=NC(=NC(=N3)N)N4CCCCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1SCC3=NC(=NC(=N3)N)N4CCCCC4

InChI

InChI=1S/C18H21N7S/c1-12-16(21-14-8-4-3-7-13(14)20-12)26-11-15-22-17(19)24-18(23-15)25-9-5-2-6-10-25/h3-4,7-8H,2,5-6,9-11H2,1H3,(H2,19,22,23,24)