6-(cyclopentylsulfanylmethyl)-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(cyclopentylsulfanylmethyl)-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(cyclopentylsulfanylmethyl)-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(cyclopentylthio)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(cyclopentylsulfanylmethyl)-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(cyclopentylthio)methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C16H21N5S MolecularWeight: 315.43644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3CCCC3

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3CCCC3

InChI

InChI=1S/C16H21N5S/c1-11-6-2-5-9-13(11)18-16-20-14(19-15(17)21-16)10-22-12-7-3-4-8-12/h2,5-6,9,12H,3-4,7-8,10H2,1H3,(H3,17,18,19,20,21)