6-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(5-chloro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(5-chloro-1,3-benzothiazol-2-yl)thio]methyl]-s-triazin-2-yl]amine Formula: C11H9ClN6S2 MolecularWeight: 324.81236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)SCC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)SCC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C11H9ClN6S2/c12-5-1-2-7-6(3-5)15-11(20-7)19-4-8-16-9(13)18-10(14)17-8/h1-3H,4H2,(H4,13,14,16,17,18)