2-[(2,4-dimethylphenyl)sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[(2,4-dimethylphenyl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[(2,4-dimethylphenyl)sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(2,4-dimethylphenyl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(2,4-dimethylphenyl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[(2,4-dimethylphenyl)thio]methyl]quinazolin-4-yl]amine Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3S/c1-11-7-8-15(12(2)9-11)21-10-16-19-14-6-4-3-5-13(14)17(18)20-16/h3-9H,10H2,1-2H3,(H2,18,19,20)