1-ethyl-N-[(S)-(4-ethylphenyl)-(3-fluorophenyl)methyl]benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-[(S)-(4-ethylphenyl)-(3-fluorophenyl)methyl]benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[(S)-(4-ethylphenyl)-(3-fluorophenyl)methyl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[(S)-(4-ethylphenyl)-(3-fluorophenyl)methyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[(S)-(4-ethylphenyl)-(3-fluorophenyl)methyl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[(S)-(4-ethylphenyl)-(3-fluorophenyl)methyl]benzotriazole-5-carboxamide Formula: C24H23FN4O MolecularWeight: 402.464023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)NC(=O)C3=CC4=C(C=C3)N(N=N4)CC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](C2=CC(=CC=C2)F)NC(=O)C3=CC4=C(C=C3)N(N=N4)CC

InChI

InChI=1S/C24H23FN4O/c1-3-16-8-10-17(11-9-16)23(18-6-5-7-20(25)14-18)26-24(30)19-12-13-22-21(15-19)27-28-29(22)4-2/h5-15,23H,3-4H2,1-2H3,(H,26,30)/t23-/m0/s1