N-(5-heptan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenoxy-benzamide

Systemtic Name: N-(5-heptan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenoxy-benzamide Openeye Name: N-[5-(1-ethylpentyl)-1,3,4-thiadiazol-2-yl]-3-phenoxy-benzamide CAS Name: N-(5-heptan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenoxybenzamide IUPAC Name: N-(5-heptan-3-yl-1,3,4-thiadiazol-2-yl)-3-phenoxybenzamide Traditional Name: N-[5-(1-ethylpentyl)-1,3,4-thiadiazol-2-yl]-3-phenoxy-benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=NN=C(S1)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)C1=NN=C(S1)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-3-5-10-16(4-2)21-24-25-22(28-21)23-20(26)17-11-9-14-19(15-17)27-18-12-7-6-8-13-18/h6-9,11-16H,3-5,10H2,1-2H3,(H,23,25,26)