N-(3-cyanothiophen-2-yl)-3-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]propanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]propanamide Openeye Name: N-(3-cyano-2-thienyl)-3-[[2-(4-fluoroanilino)-2-oxo-ethyl]-methyl-amino]propanamide CAS Name: N-(3-cyano-2-thiophenyl)-3-[[2-(4-fluoroanilino)-2-oxoethyl]-methylamino]propanamide IUPAC Name: N-(3-cyanothiophen-2-yl)-3-[[2-(4-fluoroanilino)-2-oxoethyl]-methylamino]propanamide Traditional Name: N-(3-cyano-2-thienyl)-3-[[2-(4-fluoroanilino)-2-keto-ethyl]-methyl-amino]propionamide Formula: C17H17FN4O2S MolecularWeight: 360.405883

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=C(C=CS1)C#N)CC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CN(CCC(=O)NC1=C(C=CS1)C#N)CC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C17H17FN4O2S/c1-22(11-16(24)20-14-4-2-13(18)3-5-14)8-6-15(23)21-17-12(10-19)7-9-25-17/h2-5,7,9H,6,8,11H2,1H3,(H,20,24)(H,21,23)