N-[4-[2-[4-(dimethylamino)-3-methyl-phenyl]ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[2-[4-(dimethylamino)-3-methyl-phenyl]ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[2-[4-(dimethylamino)-3-methyl-phenyl]ethylsulfanylcarbamoylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[[[2-[4-(dimethylamino)-3-methylphenyl]ethylthio]amino]-oxomethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[2-[4-(dimethylamino)-3-methylphenyl]ethylsulfanylcarbamoylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[[2-[4-(dimethylamino)-3-methyl-phenyl]ethylthio]carbamoylamino]phenyl]-2-fluoro-benzamide Formula: C25H27FN4O2S MolecularWeight: 466.570883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCSNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)CCSNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)N(C)C

InChI

InChI=1S/C25H27FN4O2S/c1-17-16-18(8-13-23(17)30(2)3)14-15-33-29-25(32)28-20-11-9-19(10-12-20)27-24(31)21-6-4-5-7-22(21)26/h4-13,16H,14-15H2,1-3H3,(H,27,31)(H2,28,29,32)