5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 5-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 5-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 5-[[4-(4-fluorophenyl)piperazino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide Formula: C26H25FN4OS MolecularWeight: 460.566303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)NC(=C3SC4=CC=CC=C4)C(=O)N)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)NC(=C3SC4=CC=CC=C4)C(=O)N)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H25FN4OS/c27-19-7-9-20(10-8-19)31-14-12-30(13-15-31)17-18-6-11-23-22(16-18)25(24(29-23)26(28)32)33-21-4-2-1-3-5-21/h1-11,16,29H,12-15,17H2,(H2,28,32)