1-ethyl-N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide

Systemtic Name: 1-ethyl-N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Openeye Name: 1-ethyl-N-[5-[(1S)-1-ethylpentyl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide CAS Name: 1-ethyl-N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 1-ethyl-N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Traditional Name: 1-ethyl-N-[5-[(1S)-1-ethylpentyl]-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Formula: C15H23N5OS MolecularWeight: 321.44102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=NN=C(S1)NC(=O)C2=CN(N=C2)CC

Isomeric SMILES

CCCC[C@H](CC)C1=NN=C(S1)NC(=O)C2=CN(N=C2)CC

InChI

InChI=1S/C15H23N5OS/c1-4-7-8-11(5-2)14-18-19-15(22-14)17-13(21)12-9-16-20(6-3)10-12/h9-11H,4-8H2,1-3H3,(H,17,19,21)/t11-/m0/s1