N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-(phenylmethyl)sulfonyl-ethanamide

Systemtic Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-(phenylmethyl)sulfonyl-ethanamide Openeye Name: 2-benzylsulfonyl-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-2-(phenylmethyl)sulfonylacetamide IUPAC Name: 2-benzylsulfonyl-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-benzylsulfonyl-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O3S2/c1-3-13(4-2)15-18-19-16(23-15)17-14(20)11-24(21,22)10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H,17,19,20)