N-[(4-fluorophenyl)methyl]-5-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-[(4-fluorophenyl)methyl]-5-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-[(4-fluorophenyl)methyl]-5-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-[(4-fluorophenyl)methyl]-5-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: (4-fluorobenzyl)-[5-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C18H18FN5O2S3 MolecularWeight: 451.561223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SC3=NN=C(S3)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SC3=NN=C(S3)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C18H18FN5O2S3/c19-14-5-3-13(4-6-14)11-21-17-22-23-18(28-17)27-16-8-7-15(12-20-16)29(25,26)24-9-1-2-10-24/h3-8,12H,1-2,9-11H2,(H,21,22)