N3-[3-[(4-fluorophenyl)methyl-pyridin-2-yl-amino]propyl]-N4-methyl-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine

Systemtic Name: N3-[3-[(4-fluorophenyl)methyl-pyridin-2-yl-amino]propyl]-N4-methyl-1-oxidanylidene-1,2,5-thiadiazole-3,4-diamine Openeye Name: N3-[3-[(4-fluorophenyl)methyl-(2-pyridyl)amino]propyl]-N4-methyl-1-oxo-1,2,5-thiadiazole-3,4-diamine CAS Name: N3-[3-[(4-fluorophenyl)methyl-(2-pyridinyl)amino]propyl]-N4-methyl-1-oxo-1,2,5-thiadiazole-3,4-diamine IUPAC Name: 3-N-[3-[(4-fluorophenyl)methyl-pyridin-2-ylamino]propyl]-4-N-methyl-1-oxo-1,2,5-thiadiazole-3,4-diamine Traditional Name: (4-fluorobenzyl)-[3-[[1-keto-4-(methylamino)-1,2,5-thiadiazol-3-yl]amino]propyl]-(2-pyridyl)amine Formula: C18H21FN6OS MolecularWeight: 388.462343

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NS(=O)N=C1NCCCN(CC2=CC=C(C=C2)F)C3=CC=CC=N3

Isomeric SMILES

CNC1=NS(=O)N=C1NCCCN(CC2=CC=C(C=C2)F)C3=CC=CC=N3

InChI

InChI=1S/C18H21FN6OS/c1-20-17-18(24-27(26)23-17)22-11-4-12-25(16-5-2-3-10-21-16)13-14-6-8-15(19)9-7-14/h2-3,5-10H,4,11-13H2,1H3,(H,20,23)(H,22,24)