N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonyl)propanamide

Systemtic Name: N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(benzenesulfonyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-besyl-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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