3-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-5-(prop-2-enylamino)-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-5-(prop-2-enylamino)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(allylamino)-3-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 3-[[(3-fluorophenyl)methyl-methylamino]methyl]-5-(prop-2-enylamino)-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[(3-fluorophenyl)methyl-methylamino]methyl]-5-(prop-2-enylamino)-1,3,4-thiadiazole-2-thione Traditional Name: 5-(allylamino)-3-[[(3-fluorobenzyl)-methyl-amino]methyl]-1,3,4-thiadiazole-2-thione Formula: C14H17FN4S2 MolecularWeight: 324.439983

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)CN2C(=S)SC(=N2)NCC=C

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)CN2C(=S)SC(=N2)NCC=C

InChI

InChI=1S/C14H17FN4S2/c1-3-7-16-13-17-19(14(20)21-13)10-18(2)9-11-5-4-6-12(15)8-11/h3-6,8H,1,7,9-10H2,2H3,(H,16,17)