3-(1,3-benzothiazol-2-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[4-[(1-methyl-2-imidazolyl)thio]phenyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[4-[(1-methylimidazol-2-yl)thio]phenyl]pyrazinamide Formula: C22H16N6OS2 MolecularWeight: 444.53204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H16N6OS2/c1-28-13-12-25-22(28)30-15-8-6-14(7-9-15)26-20(29)18-19(24-11-10-23-18)21-27-16-4-2-3-5-17(16)31-21/h2-13H,1H3,(H,26,29)