5-[(4-fluorophenyl)amino]-3-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(4-fluorophenyl)amino]-3-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(4-fluoroanilino)-3-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(4-fluoroanilino)-3-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(4-fluoroanilino)-3-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(4-fluoroanilino)-3-[[2-(3-pyridyl)pyrrolidino]methyl]-1,3,4-thiadiazole-2-thione Formula: C18H18FN5S2 MolecularWeight: 387.497423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CN2C(=S)SC(=N2)NC3=CC=C(C=C3)F)C4=CN=CC=C4

Isomeric SMILES

C1CC(N(C1)CN2C(=S)SC(=N2)NC3=CC=C(C=C3)F)C4=CN=CC=C4

InChI

InChI=1S/C18H18FN5S2/c19-14-5-7-15(8-6-14)21-17-22-24(18(25)26-17)12-23-10-2-4-16(23)13-3-1-9-20-11-13/h1,3,5-9,11,16H,2,4,10,12H2,(H,21,22)