N-cyclopropyl-3-fluoranyl-4-methyl-5-[4-(2-methylsulfanylethylcarbamoyl)phenyl]benzamide

Systemtic Name: N-cyclopropyl-3-fluoranyl-4-methyl-5-[4-(2-methylsulfanylethylcarbamoyl)phenyl]benzamide Openeye Name: N-cyclopropyl-3-fluoro-4-methyl-5-[4-(2-methylsulfanylethylcarbamoyl)phenyl]benzamide CAS Name: N-cyclopropyl-3-fluoro-4-methyl-5-[4-[[2-(methylthio)ethylamino]-oxomethyl]phenyl]benzamide IUPAC Name: N-cyclopropyl-3-fluoro-4-methyl-5-[4-(2-methylsulfanylethylcarbamoyl)phenyl]benzamide Traditional Name: N-cyclopropyl-3-fluoro-4-methyl-5-[4-[2-(methylthio)ethylcarbamoyl]phenyl]benzamide Formula: C21H23FN2O2S MolecularWeight: 386.482923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C2=CC=C(C=C2)C(=O)NCCSC)C(=O)NC3CC3)F

Isomeric SMILES

CC1=C(C=C(C=C1C2=CC=C(C=C2)C(=O)NCCSC)C(=O)NC3CC3)F

InChI

InChI=1S/C21H23FN2O2S/c1-13-18(11-16(12-19(13)22)21(26)24-17-7-8-17)14-3-5-15(6-4-14)20(25)23-9-10-27-2/h3-6,11-12,17H,7-10H2,1-2H3,(H,23,25)(H,24,26)