2-[(2-methylphenyl)-phenyl-methyl]sulfanylpyrimidine-4,6-diamine

Systemtic Name: 2-[(2-methylphenyl)-phenyl-methyl]sulfanylpyrimidine-4,6-diamine Openeye Name: 2-[o-tolyl(phenyl)methyl]sulfanylpyrimidine-4,6-diamine CAS Name: 2-[[(2-methylphenyl)-phenylmethyl]thio]pyrimidine-4,6-diamine IUPAC Name: 2-[(2-methylphenyl)-phenylmethyl]sulfanylpyrimidine-4,6-diamine Traditional Name: [6-amino-2-[[o-tolyl(phenyl)methyl]thio]pyrimidin-4-yl]amine Formula: C18H18N4S MolecularWeight: 322.42732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2)SC3=NC(=CC(=N3)N)N

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2)SC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C18H18N4S/c1-12-7-5-6-10-14(12)17(13-8-3-2-4-9-13)23-18-21-15(19)11-16(20)22-18/h2-11,17H,1H3,(H4,19,20,21,22)