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

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxy-1-(4-fluorophenyl)pyrazole-3-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxy-1-(4-fluorophenyl)pyrazole-3-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]-4-ethoxy-1-(4-fluorophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxy-1-(4-fluorophenyl)pyrazole-3-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]-4-ethoxy-1-(4-fluorophenyl)pyrazole-3-carboxamide Formula: C16H15FN6O3S2 MolecularWeight: 422.457103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(N=C1C(=O)NC2=NN=C(S2)SCC(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CN(N=C1C(=O)NC2=NN=C(S2)SCC(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H15FN6O3S2/c1-2-26-11-7-23(10-5-3-9(17)4-6-10)22-13(11)14(25)19-15-20-21-16(28-15)27-8-12(18)24/h3-7H,2,8H2,1H3,(H2,18,24)(H,19,20,25)