N-[2,5-diethoxy-4-(ethylcarbamothioylamino)phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2,5-diethoxy-4-(ethylcarbamothioylamino)phenyl]-3-fluoranyl-benzamide Openeye Name: N-[2,5-diethoxy-4-(ethylcarbamothioylamino)phenyl]-3-fluoro-benzamide CAS Name: N-[2,5-diethoxy-4-[[ethylamino(sulfanylidene)methyl]amino]phenyl]-3-fluorobenzamide IUPAC Name: N-[2,5-diethoxy-4-(ethylcarbamothioylamino)phenyl]-3-fluorobenzamide Traditional Name: N-[2,5-diethoxy-4-(ethylthiocarbamoylamino)phenyl]-3-fluoro-benzamide Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=C(C=C(C(=C1)OCC)NC(=O)C2=CC(=CC=C2)F)OCC

Isomeric SMILES

CCNC(=S)NC1=C(C=C(C(=C1)OCC)NC(=O)C2=CC(=CC=C2)F)OCC

InChI

InChI=1S/C20H24FN3O3S/c1-4-22-20(28)24-16-12-17(26-5-2)15(11-18(16)27-6-3)23-19(25)13-8-7-9-14(21)10-13/h7-12H,4-6H2,1-3H3,(H,23,25)(H2,22,24,28)