N-(2-azanylethyl)-3-[[3,5-bis(fluoranyl)phenyl]methyl]-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-(2-azanylethyl)-3-[[3,5-bis(fluoranyl)phenyl]methyl]-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-(2-aminoethyl)-3-[(3,5-difluorophenyl)methyl]-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-(2-aminoethyl)-3-[(3,5-difluorophenyl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-(2-aminoethyl)-3-[(3,5-difluorophenyl)methyl]-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-(2-aminoethyl)-3-(3,5-difluorobenzyl)-2-thioxo-4-imidazoline-4-carboxamide Formula: C13H14F2N4OS MolecularWeight: 312.338266

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)CN2C(=CNC2=S)C(=O)NCCN

Isomeric SMILES

C1=C(C=C(C=C1F)F)CN2C(=CNC2=S)C(=O)NCCN

InChI

InChI=1S/C13H14F2N4OS/c14-9-3-8(4-10(15)5-9)7-19-11(6-18-13(19)21)12(20)17-2-1-16/h3-6H,1-2,7,16H2,(H,17,20)(H,18,21)