2-(4-fluorophenyl)-4-[(1-methyl-4-methylsulfanyl-pyrrolidin-2-yl)methylamino]-N-(4-methylsulfanylbutan-2-yl)benzamide

Systemtic Name: 2-(4-fluorophenyl)-4-[(1-methyl-4-methylsulfanyl-pyrrolidin-2-yl)methylamino]-N-(4-methylsulfanylbutan-2-yl)benzamide Openeye Name: 2-(4-fluorophenyl)-N-(1-methyl-3-methylsulfanyl-propyl)-4-[(1-methyl-4-methylsulfanyl-pyrrolidin-2-yl)methylamino]benzamide CAS Name: 2-(4-fluorophenyl)-4-[[1-methyl-4-(methylthio)-2-pyrrolidinyl]methylamino]-N-[4-(methylthio)butan-2-yl]benzamide IUPAC Name: 2-(4-fluorophenyl)-4-[(1-methyl-4-methylsulfanylpyrrolidin-2-yl)methylamino]-N-(4-methylsulfanylbutan-2-yl)benzamide Traditional Name: 2-(4-fluorophenyl)-N-[1-methyl-3-(methylthio)propyl]-4-[[1-methyl-4-(methylthio)pyrrolidin-2-yl]methylamino]benzamide Formula: C25H34FN3OS2 MolecularWeight: 475.685363

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCSC)NC(=O)C1=C(C=C(C=C1)NCC2CC(CN2C)SC)C3=CC=C(C=C3)F

Isomeric SMILES

CC(CCSC)NC(=O)C1=C(C=C(C=C1)NCC2CC(CN2C)SC)C3=CC=C(C=C3)F

InChI

InChI=1S/C25H34FN3OS2/c1-17(11-12-31-3)28-25(30)23-10-9-20(13-24(23)18-5-7-19(26)8-6-18)27-15-21-14-22(32-4)16-29(21)2/h5-10,13,17,21-22,27H,11-12,14-16H2,1-4H3,(H,28,30)