5-(1,3-benzothiazol-5-yl)pyrimidine-2,4-diamine

Systemtic Name: 5-(1,3-benzothiazol-5-yl)pyrimidine-2,4-diamine Openeye Name: 5-(1,3-benzothiazol-5-yl)pyrimidine-2,4-diamine CAS Name: 5-(1,3-benzothiazol-5-yl)pyrimidine-2,4-diamine IUPAC Name: 5-(1,3-benzothiazol-5-yl)pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(1,3-benzothiazol-5-yl)pyrimidin-4-yl]amine Formula: C11H9N5S MolecularWeight: 243.28766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C3=CN=C(N=C3N)N)N=CS2

Isomeric SMILES

C1=CC2=C(C=C1C3=CN=C(N=C3N)N)N=CS2

InChI

InChI=1S/C11H9N5S/c12-10-7(4-14-11(13)16-10)6-1-2-9-8(3-6)15-5-17-9/h1-5H,(H4,12,13,14,16)