N-pentan-3-yl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-pentan-3-yl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(1-ethylpropyl)acetamide CAS Name: N-pentan-3-yl-2-[[5-[(phenylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-pentan-3-ylacetamide Traditional Name: 2-[[5-(benzylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(1-ethylpropyl)acetamide Formula: C16H22N4OS2 MolecularWeight: 350.50208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NN=C(S1)NCC2=CC=CC=C2

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NN=C(S1)NCC2=CC=CC=C2

InChI

InChI=1S/C16H22N4OS2/c1-3-13(4-2)18-14(21)11-22-16-20-19-15(23-16)17-10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H,17,19)(H,18,21)