3-iodanyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide

Systemtic Name: 3-iodanyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Openeye Name: 3-iodo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide CAS Name: 3-iodo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide IUPAC Name: 3-iodo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Traditional Name: 3-iodo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Formula: C17H15IN4O MolecularWeight: 418.23167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC(=CC=C3)I

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C17H15IN4O/c1-12(21-17(23)14-3-2-4-15(18)9-14)13-5-7-16(8-6-13)22-11-19-10-20-22/h2-12H,1H3,(H,21,23)/t12-/m0/s1