N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-6-morpholin-4-yl-pyrazine-2-carboxamide

Systemtic Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-6-morpholin-4-yl-pyrazine-2-carboxamide Openeye Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-6-morpholino-pyrazine-2-carboxamide CAS Name: N-[2-(1-benzotriazolylmethylthio)-1,3-benzothiazol-6-yl]-6-(4-morpholinyl)-2-pyrazinecarboxamide IUPAC Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-6-morpholin-4-ylpyrazine-2-carboxamide Traditional Name: N-[2-(benzotriazol-1-ylmethylthio)-1,3-benzothiazol-6-yl]-6-morpholino-pyrazinamide Formula: C23H20N8O2S2 MolecularWeight: 504.5873

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=CN=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1COCCN1C2=NC(=CN=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C23H20N8O2S2/c32-22(18-12-24-13-21(26-18)30-7-9-33-10-8-30)25-15-5-6-17-20(11-15)35-23(27-17)34-14-31-19-4-2-1-3-16(19)28-29-31/h1-6,11-13H,7-10,14H2,(H,25,32)