1-ethyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-(2-morpholino-1,3-benzothiazol-6-yl)benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-(2-morpholino-1,3-benzothiazol-6-yl)benzotriazole-5-carboxamide Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5)N=N1

InChI

InChI=1S/C20H20N6O2S/c1-2-26-17-6-3-13(11-16(17)23-24-26)19(27)21-14-4-5-15-18(12-14)29-20(22-15)25-7-9-28-10-8-25/h3-6,11-12H,2,7-10H2,1H3,(H,21,27)