N-[4-[3-[(4-dimethylaminophenyl)amino]-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[3-[(4-dimethylaminophenyl)amino]-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[4-[3-[4-(dimethylamino)anilino]-3-oxo-propyl]thiazol-2-yl]-4-fluoro-benzamide CAS Name: N-[4-[3-[4-(dimethylamino)anilino]-3-oxopropyl]-2-thiazolyl]-4-fluorobenzamide IUPAC Name: N-[4-[3-[4-(dimethylamino)anilino]-3-oxopropyl]-1,3-thiazol-2-yl]-4-fluorobenzamide Traditional Name: N-[4-[3-[4-(dimethylamino)anilino]-3-keto-propyl]thiazol-2-yl]-4-fluoro-benzamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)CCC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)CCC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O2S/c1-26(2)18-10-7-16(8-11-18)23-19(27)12-9-17-13-29-21(24-17)25-20(28)14-3-5-15(22)6-4-14/h3-8,10-11,13H,9,12H2,1-2H3,(H,23,27)(H,24,25,28)