N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-phenethyl-benzamide

Systemtic Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-phenethyl-benzamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-2-phenethyl-benzamide CAS Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-phenethylbenzamide IUPAC Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-phenethylbenzamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-2-phenethyl-benzamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3OS/c1-3-17(4-2)21-24-25-22(27-21)23-20(26)19-13-9-8-12-18(19)15-14-16-10-6-5-7-11-16/h5-13,17H,3-4,14-15H2,1-2H3,(H,23,25,26)