N-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-fluorophenyl)imidazole-4-carboxamide

Systemtic Name: N-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-fluorophenyl)imidazole-4-carboxamide Openeye Name: N-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-fluorophenyl)imidazole-4-carboxamide CAS Name: N-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-fluorophenyl)-4-imidazolecarboxamide IUPAC Name: N-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-fluorophenyl)imidazole-4-carboxamide Traditional Name: N-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4-fluorophenyl)imidazole-4-carboxamide Formula: C19H16FN3O3 MolecularWeight: 353.347043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=CN=CN3C4=CC=C(C=C4)F

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCO2)NC(=O)C3=CN=CN3C4=CC=C(C=C4)F

InChI

InChI=1S/C19H16FN3O3/c1-12(13-2-7-17-18(8-13)26-11-25-17)22-19(24)16-9-21-10-23(16)15-5-3-14(20)4-6-15/h2-10,12H,11H2,1H3,(H,22,24)/t12-/m0/s1