2-azanyl-N-(2,1,3-benzothiadiazol-5-ylmethyl)-6-(furan-2-yl)pyrimidine-4-carboxamide

Systemtic Name: 2-azanyl-N-(2,1,3-benzothiadiazol-5-ylmethyl)-6-(furan-2-yl)pyrimidine-4-carboxamide Openeye Name: 2-amino-N-(2,1,3-benzothiadiazol-5-ylmethyl)-6-(2-furyl)pyrimidine-4-carboxamide CAS Name: 2-amino-N-(2,1,3-benzothiadiazol-5-ylmethyl)-6-(2-furanyl)-4-pyrimidinecarboxamide IUPAC Name: 2-amino-N-(2,1,3-benzothiadiazol-5-ylmethyl)-6-(furan-2-yl)pyrimidine-4-carboxamide Traditional Name: 2-amino-6-(2-furyl)-N-(piazthiol-5-ylmethyl)pyrimidine-4-carboxamide Formula: C16H12N6O2S MolecularWeight: 352.37048

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NC(=N2)N)C(=O)NCC3=CC4=NSN=C4C=C3

Isomeric SMILES

C1=COC(=C1)C2=CC(=NC(=N2)N)C(=O)NCC3=CC4=NSN=C4C=C3

InChI

InChI=1S/C16H12N6O2S/c17-16-19-12(14-2-1-5-24-14)7-13(20-16)15(23)18-8-9-3-4-10-11(6-9)22-25-21-10/h1-7H,8H2,(H,18,23)(H2,17,19,20)