N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide

Systemtic Name: N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide Openeye Name: N-[5-[(1S)-1-ethylpentyl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide CAS Name: N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-4-methylbenzamide IUPAC Name: N-[5-[(3S)-heptan-3-yl]-1,3,4-thiadiazol-2-yl]-4-methylbenzamide Traditional Name: N-[5-[(1S)-1-ethylpentyl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3OS/c1-4-6-7-13(5-2)16-19-20-17(22-16)18-15(21)14-10-8-12(3)9-11-14/h8-11,13H,4-7H2,1-3H3,(H,18,20,21)/t13-/m0/s1