N,1-diethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]benzotriazole-5-carboxamide

Systemtic Name: N,1-diethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]benzotriazole-5-carboxamide Openeye Name: N,1-diethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]benzotriazole-5-carboxamide CAS Name: N,1-diethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-5-benzotriazolecarboxamide IUPAC Name: N,1-diethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]benzotriazole-5-carboxamide Traditional Name: N,1-diethyl-N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]benzotriazole-5-carboxamide Formula: C20H22FN5O2 MolecularWeight: 383.419383

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N(CC)CC(=O)NCC3=CC=C(C=C3)F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N(CC)CC(=O)NCC3=CC=C(C=C3)F)N=N1

InChI

InChI=1S/C20H22FN5O2/c1-3-25(13-19(27)22-12-14-5-8-16(21)9-6-14)20(28)15-7-10-18-17(11-15)23-24-26(18)4-2/h5-11H,3-4,12-13H2,1-2H3,(H,22,27)