1-[(4-fluorophenyl)methyl]-2,3-dimethyl-N-[2-(4-methylsulfanylphenyl)ethyl]indole-5-carboxamide

Systemtic Name: 1-[(4-fluorophenyl)methyl]-2,3-dimethyl-N-[2-(4-methylsulfanylphenyl)ethyl]indole-5-carboxamide Openeye Name: 1-[(4-fluorophenyl)methyl]-2,3-dimethyl-N-[2-(4-methylsulfanylphenyl)ethyl]indole-5-carboxamide CAS Name: 1-[(4-fluorophenyl)methyl]-2,3-dimethyl-N-[2-[4-(methylthio)phenyl]ethyl]-5-indolecarboxamide IUPAC Name: 1-[(4-fluorophenyl)methyl]-2,3-dimethyl-N-[2-(4-methylsulfanylphenyl)ethyl]indole-5-carboxamide Traditional Name: 1-(4-fluorobenzyl)-2,3-dimethyl-N-[2-[4-(methylthio)phenyl]ethyl]indole-5-carboxamide Formula: C27H27FN2OS MolecularWeight: 446.579483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)NCCC3=CC=C(C=C3)SC)CC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)NCCC3=CC=C(C=C3)SC)CC4=CC=C(C=C4)F)C

InChI

InChI=1S/C27H27FN2OS/c1-18-19(2)30(17-21-4-9-23(28)10-5-21)26-13-8-22(16-25(18)26)27(31)29-15-14-20-6-11-24(32-3)12-7-20/h4-13,16H,14-15,17H2,1-3H3,(H,29,31)