[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-quinolin-8-ylsulfonyl-azanide

Systemtic Name: [5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-quinolin-8-ylsulfonyl-azanide Openeye Name: [5-[(1S)-1-ethylpentyl]-1,3,4-thiadiazol-2-yl]-(8-quinolylsulfonyl)azanide CAS Name: [5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-(8-quinolinylsulfonyl)azanide IUPAC Name: [5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-quinolin-8-ylsulfonylazanide Traditional Name: [5-[(1S)-1-ethylpentyl]-1,3,4-thiadiazol-2-yl]-(8-quinolylsulfonyl)azanide Formula: C18H21N4O2S2- MolecularWeight: 389.51494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=NN=C(S1)[N-]S(=O)(=O)C2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CCCC[C@H](CC)C1=NN=C(S1)[N-]S(=O)(=O)C2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C18H21N4O2S2/c1-3-5-8-13(4-2)17-20-21-18(25-17)22-26(23,24)15-11-6-9-14-10-7-12-19-16(14)15/h6-7,9-13H,3-5,8H2,1-2H3/q-1/t13-/m0/s1