4-[(2-fluorophenyl)methyl]-1-[(E)-3-thiophen-2-ylprop-2-enoyl]-1,4-diazepan-5-one

Systemtic Name: 4-[(2-fluorophenyl)methyl]-1-[(E)-3-thiophen-2-ylprop-2-enoyl]-1,4-diazepan-5-one Openeye Name: 4-[(2-fluorophenyl)methyl]-1-[(E)-3-(2-thienyl)prop-2-enoyl]-1,4-diazepan-5-one CAS Name: 4-[(2-fluorophenyl)methyl]-1-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-1,4-diazepan-5-one IUPAC Name: 4-[(2-fluorophenyl)methyl]-1-[(E)-3-thiophen-2-ylprop-2-enoyl]-1,4-diazepan-5-one Traditional Name: 4-(2-fluorobenzyl)-1-[(E)-3-(2-thienyl)acryloyl]-1,4-diazepan-5-one Formula: C19H19FN2O2S MolecularWeight: 358.429763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CC2=CC=CC=C2F)C(=O)C=CC3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1=O)CC2=CC=CC=C2F)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C19H19FN2O2S/c20-17-6-2-1-4-15(17)14-22-12-11-21(10-9-19(22)24)18(23)8-7-16-5-3-13-25-16/h1-8,13H,9-12,14H2/b8-7+