3-[2-(1-cyclopropylimidazol-2-yl)sulfanylethanoyl-(4-fluorophenyl)amino]propanamide

Systemtic Name: 3-[2-(1-cyclopropylimidazol-2-yl)sulfanylethanoyl-(4-fluorophenyl)amino]propanamide Openeye Name: 3-(N-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]-4-fluoro-anilino)propanamide CAS Name: 3-(N-[2-[(1-cyclopropyl-2-imidazolyl)thio]-1-oxoethyl]-4-fluoroanilino)propanamide IUPAC Name: 3-(N-[2-(1-cyclopropylimidazol-2-yl)sulfanylacetyl]-4-fluoroanilino)propanamide Traditional Name: 3-(N-[2-[(1-cyclopropylimidazol-2-yl)thio]acetyl]-4-fluoro-anilino)propionamide Formula: C17H19FN4O2S MolecularWeight: 362.421763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=CN=C2SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

C1CC1N2C=CN=C2SCC(=O)N(CCC(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H19FN4O2S/c18-12-1-3-13(4-2-12)21(9-7-15(19)23)16(24)11-25-17-20-8-10-22(17)14-5-6-14/h1-4,8,10,14H,5-7,9,11H2,(H2,19,23)