1-(4-fluorophenyl)-4-methoxy-N-[5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-4-methoxy-N-[5-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,3,4-thiadiazol-2-yl]pyrazole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-[5-[(2-keto-2-pyrrolidino-ethyl)thio]-1,3,4-thiadiazol-2-yl]-4-methoxy-pyrazole-3-carboxamide Formula: C19H19FN6O3S2 MolecularWeight: 462.520963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2=NN=C(S2)SCC(=O)N3CCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2=NN=C(S2)SCC(=O)N3CCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H19FN6O3S2/c1-29-14-10-26(13-6-4-12(20)5-7-13)24-16(14)17(28)21-18-22-23-19(31-18)30-11-15(27)25-8-2-3-9-25/h4-7,10H,2-3,8-9,11H2,1H3,(H,21,22,28)