[4-azanyl-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl]methanethiol

Systemtic Name: [4-azanyl-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl]methanethiol Openeye Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methanethiol CAS Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methanethiol IUPAC Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methanethiol Traditional Name: [4-amino-6-(p-toluidino)-s-triazin-2-yl]methanethiol Formula: C11H13N5S MolecularWeight: 247.31942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CS

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CS

InChI

InChI=1S/C11H13N5S/c1-7-2-4-8(5-3-7)13-11-15-9(6-17)14-10(12)16-11/h2-5,17H,6H2,1H3,(H3,12,13,14,15,16)