1-ethyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-(3-pyrrolidinoquinoxalin-2-yl)benzotriazole-5-carboxamide Formula: C21H21N7O MolecularWeight: 387.43774

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=NC4=CC=CC=C4N=C3N5CCCC5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=NC4=CC=CC=C4N=C3N5CCCC5)N=N1

InChI

InChI=1S/C21H21N7O/c1-2-28-18-10-9-14(13-17(18)25-26-28)21(29)24-19-20(27-11-5-6-12-27)23-16-8-4-3-7-15(16)22-19/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,22,24,29)