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

Systemtic Name: 2-[(4-azanyl-2-chloranyl-phenyl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[(4-amino-2-chloro-phenyl)sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(4-amino-2-chlorophenyl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(4-amino-2-chlorophenyl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[(4-amino-2-chloro-phenyl)thio]methyl]quinazolin-4-yl]amine Formula: C15H13ClN4S MolecularWeight: 316.80852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=C(C=C(C=C3)N)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=C(C=C(C=C3)N)Cl)N

InChI

InChI=1S/C15H13ClN4S/c16-11-7-9(17)5-6-13(11)21-8-14-19-12-4-2-1-3-10(12)15(18)20-14/h1-7H,8,17H2,(H2,18,19,20)