5-[(4-chlorophenyl)sulfanylmethyl]quinazoline-2,4-diamine

Systemtic Name: 5-[(4-chlorophenyl)sulfanylmethyl]quinazoline-2,4-diamine Openeye Name: 5-[(4-chlorophenyl)sulfanylmethyl]quinazoline-2,4-diamine CAS Name: 5-[[(4-chlorophenyl)thio]methyl]quinazoline-2,4-diamine IUPAC Name: 5-[(4-chlorophenyl)sulfanylmethyl]quinazoline-2,4-diamine Traditional Name: [2-amino-5-[[(4-chlorophenyl)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)N=C(N=C2N)N)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=C2C(=C1)N=C(N=C2N)N)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H13ClN4S/c16-10-4-6-11(7-5-10)21-8-9-2-1-3-12-13(9)14(17)20-15(18)19-12/h1-7H,8H2,(H4,17,18,19,20)