1-ethyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]benzotriazole-5-carboxamide Formula: C21H18FN5O3S MolecularWeight: 439.462723

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)F)N=N1

InChI

InChI=1S/C21H18FN5O3S/c1-2-27-20-12-3-14(13-19(20)24-26-27)21(28)23-16-6-8-17(9-7-16)25-31(29,30)18-10-4-15(22)5-11-18/h3-13,25H,2H2,1H3,(H,23,28)