2-[(2-azanyl-4-methyl-phenyl)sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[(2-azanyl-4-methyl-phenyl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[(2-amino-4-methyl-phenyl)sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(2-amino-4-methylphenyl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(2-amino-4-methylphenyl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[(2-amino-4-methyl-phenyl)thio]methyl]quinazolin-4-yl]amine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=NC3=CC=CC=C3C(=N2)N)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=NC3=CC=CC=C3C(=N2)N)N

InChI

InChI=1S/C16H16N4S/c1-10-6-7-14(12(17)8-10)21-9-15-19-13-5-3-2-4-11(13)16(18)20-15/h2-8H,9,17H2,1H3,(H2,18,19,20)